N1-(4-methoxyphenyl)ethane-1,2-diamine

N1-(4-methoxyphenyl)ethane-1,2-diamine

CAS: 24455-93-4

Formula: C9H14N2O

SMILES: COC1=CC=C(NCCN)C=C1

IUPAC: N1-(4-methoxyphenyl)ethane-1,2-diamine

InChI: InChI=1S/C9H14N2O/c1-12-9-4-2-8(3-5-9)11-7-6-10/h2-5,11H,6-7,10H2,1H3

Composition: C (65.03%), H (8.49%), N (16.85%), O (9.62%)

Molar Mass: 166.224

Atom Count: 26

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	166.110613079
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	LOEIZBNJCZKXFJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.66
Topological Polar Surface Area	47.28
Polarizability	19.2
Ring Count	1
Rotatable Bond Count	4

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