1-(3-methylphenyl)methanamine

1-(3-methylphenyl)methanamine

CAS: 100-81-2

Formula: C8H11N

SMILES: CC1=CC=CC(CN)=C1

IUPAC: 1-(3-methylphenyl)methanamine

InChI: InChI=1S/C8H11N/c1-7-3-2-4-8(5-7)6-9/h2-5H,6,9H2,1H3

Composition: C (79.29%), H (9.15%), N (11.56%)

Molar Mass: 121.183

Atom Count: 20

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	121.089149358
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	RGXUCUWVGKLACF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.57
Topological Polar Surface Area	26.02
Polarizability	15.51
Ring Count	1
Rotatable Bond Count	1

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