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5,7-difluoro-3,4-dihydro-2H-1-benzopyran-4-amine

5,7-difluoro-3,4-dihydro-2H-1-benzopyran-4-amine

CAS: 886762-87-4

Formula: C9H9F2NO

SMILES: NC1CCOC2=CC(F)=CC(F)=C12

IUPAC: 5,7-difluoro-3,4-dihydro-2H-1-benzopyran-4-amine

InChI: InChI=1/C9H9F2NO/c10-5-3-6(11)9-7(12)1-2-13-8(9)4-5/h3-4,7H,1-2,12H2

Composition: C (58.38%), H (4.90%), F (20.52%), N (7.56%), O (8.64%)

Molar Mass: 185.174

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 185.06522024
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZJGYMNXLPZADME-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.99
Topological Polar Surface Area 35.25
Polarizability 16.75
Ring Count 2
Rotatable Bond Count 0

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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 886762-87-4 $373.75-$3,670.80$373.75$631.35$1,147.70$3,670.80
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