N1-(3-chlorophenyl)-2-methylpropane-1,2-diamine

N1-(3-chlorophenyl)-2-methylpropane-1,2-diamine

CAS: 854650-27-4

Formula: C10H15ClN2

SMILES: CC(C)(N)CNC1=CC(Cl)=CC=C1

IUPAC: N1-(3-chlorophenyl)-2-methylpropane-1,2-diamine

InChI: InChI=1S/C10H15ClN2/c1-10(2,12)7-13-9-5-3-4-8(11)6-9/h3-6,13H,7,12H2,1-2H3

Composition: C (60.45%), H (7.61%), Cl (17.84%), N (14.10%)

Molar Mass: 198.69

Atom Count: 28

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	198.0923762
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	IKWXSOGQJGFBFT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.06
Topological Polar Surface Area	38.05
Polarizability	22.22
Ring Count	1
Rotatable Bond Count	3

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