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4-chloro-3-methylbenzene-1,2-diamine

4-chloro-3-methylbenzene-1,2-diamine

CAS: 673487-36-0

Formula: C7H9ClN2

SMILES: CC1=C(N)C(N)=CC=C1Cl

IUPAC: 4-chloro-3-methylbenzene-1,2-diamine

InChI: InChI=1S/C7H9ClN2/c1-4-5(8)2-3-6(9)7(4)10/h2-3H,9-10H2,1H3

Composition: C (53.68%), H (5.79%), Cl (22.64%), N (17.89%)

Molar Mass: 156.61

Atom Count: 19

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 156.045426
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey MJASWYJHGMJHER-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.3
Topological Polar Surface Area 52.04
Polarizability 16.23
Ring Count 1
Rotatable Bond Count 0

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