HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride

HCID 58453
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
101491-76-3
Standard SMILES
CN(C)C(=O)Oc1cccc[nH+]1.[Cl-]
InChIKey
XMPAAUQMEHXKFZ-UHFFFAOYSA-N
Molecular formula
C8H11ClN2O2
Average molar mass
202.64 g/mol
Monoisotopic mass
202.0509053

Names & identifiers

Preferred name
Carbamic acid, dimethyl-, 2-pyridyl ester, hydrochloride
IUPAC
pyridin-1-ium-2-yl N,N-dimethylcarbamate chloride

Names & synonyms

101491-76-3CARBAMIC ACID, DIMETHYL-, 2-PYRIDYL ESTER, HYDROCHLORIDERefChem:10808932-Pyridyl dimethylcarbamate hydrochlorideSB-25N,N-Dimethylcarbamic acid 2-pyridyl ester hydrochlorideCarbamic acid, N,N-dimethyl-, beta-pyridyl ester, hydrochloridepyridin-1-ium-2-yl N,N-dimethylcarbamate;chloride

Database identifiers

CAS
101491-76-3
PubChem CID
58453

Properties

Computed structural properties

Topological polar surface area
43.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
159

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes