1,4-Benzenediamine, N1,N1-bis(2-chloroethyl)-, hydrochloride (1:?)

HCID 215727

Basic information

CAS
36134-83-5
Standard SMILES
Cl.Nc1ccc(N(CCCl)CCCl)cc1
InChIKey
SNFZPEZEZZWYMP-UHFFFAOYSA-N
Molecular formula
C10H15Cl3N2
Average molar mass
269.6 g/mol
Monoisotopic mass
268.03008152

Names & identifiers

Preferred name
1,4-Benzenediamine, N1,N1-bis(2-chloroethyl)-, hydrochloride (1:?)
IUPAC
4-N,4-N-bis(2-chloroethyl)benzene-1,4-diamine;hydrochloride

Names & synonyms

36134-83-5p-Phenylenediamine, N,N-bis(2-chloroethyl)-, hydrochlorideDTXSID30189711RefChem:1053151DTXCID901122021,4-Benzenediamine, N1,N1-bis(2-chloroethyl)-, hydrochloride (1:?)945-68-6p-Phenylenediamine, N-bis(2-chloroethyl)-, hydrochloride1,4-Benzenediamine, N,N-bis(2-chloroethyl)-, hydrochlorideCHEMBL543027SCHEMBL3838748N1,N1-Bis(2-chloroethyl)benzene-1,4-diamine xhydrochloride
Show more names
NSC44303NSC-44303N,N-bis(2-chloroethyl)-p-phenylenediamine hydrochloridep-Phenylenediamine,N-bis(2-chloroethyl)-, hydrochloride4-N,4-N-bis(2-chloroethyl)benzene-1,4-diamine;hydrochlorideN~1~,N~1~-Bis(2-chloroethyl)benzene-1,4-diamine--hydrogen chloride (1/1)

Database identifiers

CAS
36134-83-5、945-68-6
PubChem CID
215727
DTXSID
DTXSID30189711
ChEMBL
CHEMBL543027

Properties

Computed structural properties

Topological polar surface area
29.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
15

Related reactions

13 records

Compound notes

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