Substances (GSRS)

1-Butyl-2-methylpyridinium

Also: Pyridinium, 1-butyl-2-methyl-

chemicalUNII 7XST4PXW8J

Open FDA's page for this record

Substance class

chemical

Definition type

PRIMARY

Definition level

COMPLETE

Uuid

84aedfb1-e918-49d0-ad2e-731d4736abd2

Version

UNII

7XST4PXW8J

Codes

Uuid
11c1b971-1efa-460f-bb41-c523dc1f117c
Code
13240378
Type
PRIMARY
Url
https://pubchem.ncbi.nlm.nih.gov/compound/13240378
Code system
PUBCHEM
References
cba6a1e3-24c1-462f-a344-96b6d588bd79
Uuid
7ec31819-d0f5-4ce9-9f1e-eb45b29e01ab
Code
125780-60-1
Type
PRIMARY
Url
https://commonchemistry.cas.org/detail?cas_rn=125780-60-1
Code system
CAS
References
e84101af-fbfd-4079-9ee3-2b0bba2e820d
Uuid
6d24a24d-4034-4d0b-8ceb-18a80f2f970f
Code
7XST4PXW8J
Type
PRIMARY
Code system
FDA UNII

Relationships

Uuid
dfdd56e2-a99f-4f7f-b9bf-00b9e194d9c4
Type
SALT/SOLVATE->PARENT
Amount
Uuid
44e56243-2d99-44ce-8b89-695ed74a0beb
Related substance
Uuid
21dd7afe-007c-4985-96bc-f7b711035391
Refuuid
74d78999-f251-46bc-87df-63852571205b
Name
1-Butyl-2-methylpyridinium chloride
UNII
D36J258MQW
Linking ID
D36J258MQW
Ref pname
1-Butyl-2-methylpyridinium chloride
Substance class
reference
Uuid
f7c4cdd1-42e7-4e62-b7e4-d867b5ea54ed
Type
IONIC MOIETY
Amount
Uuid
99762551-846e-480b-8bdd-3099956299f2
References
e84101af-fbfd-4079-9ee3-2b0bba2e820d
Related substance
Uuid
8baa0025-6bfa-4bb7-a0fe-8a43fff78dc7
Refuuid
84aedfb1-e918-49d0-ad2e-731d4736abd2
Name
1-Butyl-2-methylpyridinium
UNII
7XST4PXW8J
Linking ID
7XST4PXW8J
Ref pname
1-Butyl-2-methylpyridinium
Substance class
reference
Uuid
59403f9d-4847-415a-8d7f-2574b0176d4d
Type
SALT/SOLVATE->PARENT
Amount
Uuid
a8a9a33b-becd-4752-916d-de10b53d59fe
References
a6a1b160-5bda-468e-975c-3e44c00edaba
Related substance
Uuid
c0299662-0fc4-4ed8-a741-cf7681f2a682
Refuuid
27c924d0-998a-4a8a-a386-99077f1a0cd2
Name
1-Butyl-2-methylpyridinium tetrafluoroborate
UNII
BZG8P7NZ3J
Linking ID
BZG8P7NZ3J
Ref pname
1-Butyl-2-methylpyridinium tetrafluoroborate
Substance class
reference
Uuid
67a6588e-ef99-4ff8-b9f4-c2f0c252b6b6
Type
SALT/SOLVATE->PARENT
Amount
Uuid
0c9db941-e288-49fb-ad6a-2909ce3f908f
References
89947547-78c4-4b01-8b5a-c536e55068a1
Related substance
Uuid
7f2e702b-39de-4375-a7db-00fc54a267bb
Refuuid
8386a00e-ebe2-452e-9f12-2a3416c6b900
Name
1-Butyl-2-methylpyridinium bromide
UNII
46VNA2U525
Linking ID
46VNA2U525
Ref pname
1-Butyl-2-methylpyridinium bromide
Substance class
reference

Names

Uuid
6a317889-6a34-4d0d-bef7-f4b6a593398d
Name
1-Butyl-2-methylpyridinium
StdName
1-BUTYL-2-METHYLPYRIDINIUM
Type
sys
Preferred
false
Display name
true
Languages
en
References
e84101af-fbfd-4079-9ee3-2b0bba2e820d
Uuid
01399a4a-8d30-40dd-a1ea-4b058f23d68a
Name
Pyridinium, 1-butyl-2-methyl-
StdName
PYRIDINIUM, 1-BUTYL-2-METHYL-
Type
sys
Preferred
false
Display name
false
Languages
en
References
e84101af-fbfd-4079-9ee3-2b0bba2e820d

References

Uuid
b34170e6-ce76-4b62-be71-4a7583a9580e
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true
Tags
PUBLIC_DOMAIN_RELEASE
Uuid
a6a1b160-5bda-468e-975c-3e44c00edaba
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true
Tags
PUBLIC_DOMAIN_RELEASE
Uuid
cba6a1e3-24c1-462f-a344-96b6d588bd79
Citation
PUBCHEM
Doc type
PUBCHEM
Public domain
true
Uuid
e84101af-fbfd-4079-9ee3-2b0bba2e820d
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true
Tags
PUBLIC_DOMAIN_RELEASE, NOMEN
Uuid
33af971c-e462-42b0-a3d7-81371fcfd073
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true
Tags
PUBLIC_DOMAIN_RELEASE
Uuid
89947547-78c4-4b01-8b5a-c536e55068a1
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true
Tags
PUBLIC_DOMAIN_RELEASE

Moieties

Uuid
06422580-9b53-4626-a4a5-2ba5f3211825
ID
06422580-9b53-4626-a4a5-2ba5f3211825
Smiles
CCCC[n+]1ccccc1C
Formula
C10H16N
Atropisomerism
No
Charge
1
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
150.2411
Optical activity
NONE
Stereo centers
0
Molfile
CDK 10312416312D 11 11 0 0 0 0 0 0 0 0999 V2000 -4.8802 -1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5824 -2.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2821 -1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9843 -2.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -1.3168 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3205 0.1754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6195 0.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 0.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9145 -1.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6155 -2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6152 -3.5676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 5 10 1 0 0 0 0 10 11 1 0 0 0 0 M CHG 1 5 1 M END
Count amount
Type
MOL RATIO
Average
1
Units
MOL RATIO
Uuid
41d39d90-2e3f-40e8-8eb6-5424d52848eb

Structure

ID: 66a1a517-2671-4f3d-b5d1-21100b1df6b4
Smiles: CCCC[n+]1ccccc1C
Formula: C10H16N
Atropisomerism: No
Charge: 1
Count: 1
Stereochemistry: ACHIRAL
Defined stereo: 0
Ez centers: 0
Molecular weight: 150.2411
Optical activity: NONE
Stereo centers: 0
Molfile: CDK 10312416312D 11 11 0 0 0 0 0 0 0 0999 V2000 -4.8802 -1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5824 -2.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2821 -1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9843 -2.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -1.3168 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3205 0.1754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6195 0.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 0.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9145 -1.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6155 -2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6152 -3.5676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 5 10 1 0 0 0 0 10 11 1 0 0 0 0 M CHG 1 5 1 M END
References: e84101af-fbfd-4079-9ee3-2b0bba2e820d

Data from openFDA, FDA's public API. FDA says not to rely on it to make decisions about medical care and to treat every result as unvalidated; confirm against FDA's own record and the product labeling. Not medical or legal advice.