p-Arsanilic acid, N-(2-chloroethyl)-N-methyl-
Basic information
- CAS
5185-72-8- Standard SMILES
CN(CCCl)c1ccc([As](=O)(O)O)cc1- InChIKey
IFUZYDZFQPYFIU-UHFFFAOYSA-N- Molecular formula
- C9H13AsClNO3
- Average molar mass
- 293.58 g/mol
- Monoisotopic mass
- 292.979991
Names & identifiers
- Preferred name
- p-Arsanilic acid, N-(2-chloroethyl)-N-methyl-
- IUPAC
- [4-[2-chloroethyl(methyl)amino]phenyl]arsonic acid
- English name
- [4-[2-Chloroethyl(methyl)amino]phenyl]arsonic acid
- Molecular formula
- C9H13AsClNO3
- Molecular weight
- 293.58
Names & synonyms
BRN 28417025185-72-8p-ARSANILIC ACID, N-(2-CHLOROETHYL)-N-METHYL-N-(2-Chloroethyl)-N-methyl-p-arsanilic acidDTXSID80199805RefChem:367585DTXCID00122296{4-[(2-chloroethyl)(methyl)amino]phenyl}arsonic acid[4-[2-Chloroethyl(methyl)amino]phenyl]arsonic acidArsanilic acid, N-(2-chloroethyl)-N-methyl- (7CI,8CI)
Database identifiers
- CAS
5185-72-8- PubChem CID
- 21252
- DTXSID
DTXSID80199805- Nikkaji
- J55.396D
Properties
Computed structural properties
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 238
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Compound notes
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