Molecular Identity
3,3'-Dichloro-4,4'-Diaminodiphenylmethane
4-[(4-amino-3-chlorophenyl)methyl]-2-chloroaniline
PubChem CID: 7543
4,4'-Methylene bis(2-chloroaniline) can cause cancer according to state or federal government labeling requirements.
2D Structure
Properties
C13H12Cl2N2
Molecular Formula
267.15
Molecular Weight
g/mol
266.0378
Exact Mass
Da
3.8
XLogP
Drug-like (Lipinski: < 5)
52
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
2
H-Bond Acceptors
226
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)Cl)Cl)NIsomeric SMILES
SMILES: C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)Cl)Cl)NSynonyms(20)
101-14-44,4'-METHYLENEBIS(2-CHLOROANILINE)MOCABisamineCyanasetMethylenebis(chloroaniline)4,4'-Methylene bis(2-chloroaniline)DacpmCuralin MDiamet KhCL-MdaBis amineMillionate MBisamine SCuamine M
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 3,3'-Dichloro-4,4'-Diaminodiphenylmethane
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