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1391361-52-6 | Benzenemethanamine, 4-fluoro-α-2-propen-1-yl-, hydrochloride (1:1), (αR)-
CAS No: 1391361-52-6 Catalog No: AG001ACW MDL No:MFCD12068566
Product Description
Catalog Number:
AG001ACW
Chemical Name:
Benzenemethanamine, 4-fluoro-α-2-propen-1-yl-, hydrochloride (1:1), (αR)-
CAS Number:
1391361-52-6
Molecular Formula:
C10H13ClFN
Molecular Weight:
201.6683
MDL Number:
MFCD12068566
IUPAC Name:
(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
InChI Key:
TXYCZYDHHPXNIK-HNCPQSOCSA-N
SMILES:
C=CC[C@H](c1ccc(cc1)F)N.Cl
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
201.072g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.669g/mol
Monoisotopic Mass:
201.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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