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(1R)-1-(4-fluorophenyl)but-3-en-1-amine hydrochloride

(1R)-1-(4-fluorophenyl)but-3-en-1-amine hydrochloride

CAS: 1391361-52-6

Formula: C10H13ClFN

SMILES: Cl.N[C@H](CC=C)C1=CC=C(F)C=C1

IUPAC: (1R)-1-(4-fluorophenyl)but-3-en-1-amine hydrochloride

InChI: InChI=1S/C10H12FN.ClH/c1-2-3-10(12)8-4-6-9(11)7-5-8;/h2,4-7,10H,1,3,12H2;1H/t10-;/m1./s1

Composition: C (59.56%), H (6.50%), Cl (17.58%), F (9.42%), N (6.95%)

Molar Mass: 201.67

Atom Count: 26

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 201.0720553
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey TXYCZYDHHPXNIK-HNCPQSOCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.34
Topological Polar Surface Area 26.02
Polarizability 18.62
Ring Count 1
Rotatable Bond Count 3

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