Home Amines 102074-47-5
102074-47-5,MFCD10694367
Catalog No.:AA0006IC
102074-47-5 | 1,2-Benzenediamine, 3-chloro-N2-methyl-
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  • Technical Information
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Technical Information
Catalog Number:
AA0006IC
Chemical Name:
1,2-Benzenediamine, 3-chloro-N2-methyl-
CAS Number:
102074-47-5
Molecular Formula:
C7H9ClN2
Molecular Weight:
156.6128
MDL Number:
MFCD10694367
IUPAC Name:
3-chloro-2-N-methylbenzene-1,2-diamine
InChI:
InChI=1S/C7H9ClN2/c1-10-7-5(8)3-2-4-6(7)9/h2-4,10H,9H2,1H3
InChI Key:
VDDRAMKPNRSSMG-UHFFFAOYSA-N
SMILES:
CNc1c(N)cccc1Cl
Properties
Computed Properties
 
Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.045g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
156.613g/mol
Monoisotopic Mass:
156.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Synonyms
 
6-Chloro-N1-methylbenzene-1,2-diamine 
102074-47-5 
FT-0743768 
1,2-Benzenediamine, 3-chloro-N2-methyl- 
6-chloro-1-N-methylbenzene-1,2-diamine 
SCHEMBL101764 
VDDRAMKPNRSSMG-UHFFFAOYSA-N 
ZINC34939564 
NE39898 
AJ-90448 
DA-16263 
Literature
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