Urea, (p-(bis(2-chloroethyl)amino)phenyl)-
Basic information
- CAS
1215-17-4- Standard SMILES
NC(=O)Nc1ccc(N(CCCl)CCCl)cc1- InChIKey
IECGLDIOQJVETE-UHFFFAOYSA-N- Molecular formula
- C11H15Cl2N3O
- Average molar mass
- 276.16 g/mol
- Monoisotopic mass
- 275.0592175
Names & identifiers
- Preferred name
- Urea, (p-(bis(2-chloroethyl)amino)phenyl)-
- IUPAC
- [4-[bis(2-chloroethyl)amino]phenyl]urea
Names & synonyms
TKP7LH7VKX1215-17-4Urea, (p-(bis(2-chloroethyl)amino)phenyl)-NSC-294986Urea, [p-[bis(2-chloroethyl)amino]phenyl]-Urea, (4-(bis(2-chloroethyl)amino)phenyl)-Urea, [4-[bis(2-chloroethyl)amino]phenyl]-NSC294986UNII-TKP7LH7VKXCHEMBL167891DTXSID20923828NSC 294986
Show more names
N-{4-[Bis(2-chloroethyl)amino]phenyl}carbamimidic acidUREA, N-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)-
Database identifiers
- CAS
1215-17-4- PubChem CID
- 100402
- DTXSID
DTXSID20923828- ChEMBL
CHEMBL167891- UNII
- TKP7LH7VKX
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 227
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Related reactions
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Compound notes
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