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3-{[(4-methoxyphenyl)methyl]amino}propan-1-ol

3-{[(4-methoxyphenyl)methyl]amino}propan-1-ol

CAS: 91340-37-3

Formula: C11H17NO2

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

IUPAC: 3-{[(4-methoxyphenyl)methyl]amino}propan-1-ol

InChI: InChI=1S/C11H17NO2/c1-14-11-5-3-10(4-6-11)9-12-7-2-8-13/h3-6,12-13H,2,7-9H2,1H3

Composition: C (67.66%), H (8.78%), N (7.17%), O (16.39%)

Molar Mass: 195.262

Atom Count: 31

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 195.125928791
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey CUWZGYOFFQYIKV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.93
Topological Polar Surface Area 41.49
Polarizability 22.35
Ring Count 1
Rotatable Bond Count 6

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