Anthranilic acid, N,N-bis(2-chloroethyl)-
Basic information
- CAS
3085-99-2- Standard SMILES
O=C(O)c1ccccc1N(CCCl)CCCl- InChIKey
UXUKWLCXNDMFIX-UHFFFAOYSA-N- Molecular formula
- C11H13Cl2NO2
- Average molar mass
- 262.13 g/mol
- Monoisotopic mass
- 261.032334
Names & identifiers
- Preferred name
- Anthranilic acid, N,N-bis(2-chloroethyl)-
- IUPAC
- 2-[bis(2-chloroethyl)amino]benzoic acid
Names & synonyms
ANTHRANILIC ACID, N,N-BIS(2-CHLOROETHYL)-3085-99-2Benzoic acid, 2-[bis(2-chloroethyl)amino]-NSC 260455BRN 2809059N,N-Bis(2-chloroethyl)anthranilic acid2-(Bis(2-chloroethyl)amino)benzoic acid2-[bis(2-chloroethyl)amino]benzoic acidBenzoic acid, 2-(bis(2-chloroethyl)amino)-DTXSID501848694-14-00-01019 (Beilstein Handbook Reference)RefChem:319781
Show more names
DTXCID40107360Benzoic acid, 2-(bis(2-chloroethyl)amino)-(9CI)NSC-260455NSC260455ST5N6MSH3HSCHEMBL7476350UXUKWLCXNDMFIX-UHFFFAOYSA-NAnthranilic acid,N-bis(2-chloroethyl)-
Database identifiers
- CAS
3085-99-2- PubChem CID
- 18333
- DTXSID
DTXSID50184869- UNII
- ST5N6MSH3H
- Nikkaji
- J646.137I
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 220
Related reactions
2 records
Compound notes
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