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3,4-dihydro-2H-1-benzopyran-5-amine

3,4-dihydro-2H-1-benzopyran-5-amine

CAS: 50386-65-7

Formula: C9H11NO

SMILES: NC1=CC=CC2=C1CCCO2

IUPAC: 3,4-dihydro-2H-1-benzopyran-5-amine

InChI: InChI=1S/C9H11NO/c10-8-4-1-5-9-7(8)3-2-6-11-9/h1,4-5H,2-3,6,10H2

Composition: C (72.46%), H (7.43%), N (9.39%), O (10.72%)

Molar Mass: 149.193

Atom Count: 22

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 149.084063978
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GKJBMBKESIBFHQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.13
Topological Polar Surface Area 35.25
Polarizability 16.86
Ring Count 2
Rotatable Bond Count 0

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