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Home > Bromides > 1391452-66-6
1391452-66-6 | Pyrrolidine, 2-(3-bromophenyl)-, hydrochloride (1:1), (2S)-
CAS No: 1391452-66-6 Catalog No: AG001AEG MDL No:MFCD12910616
Product Description
Catalog Number:
AG001AEG
Chemical Name:
Pyrrolidine, 2-(3-bromophenyl)-, hydrochloride (1:1), (2S)-
CAS Number:
1391452-66-6
Molecular Formula:
C10H13BrClN
Molecular Weight:
262.5739
MDL Number:
MFCD12910616
IUPAC Name:
(2S)-2-(3-bromophenyl)pyrrolidine;hydrochloride
InChI:
InChI=1S/C10H12BrN.ClH/c11-9-4-1-3-8(7-9)10-5-2-6-12-10;/h1,3-4,7,10,12H,2,5-6H2;1H/t10-;/m0./s1
InChI Key:
CVYQYZJNUFUMJY-PPHPATTJSA-N
SMILES:
Brc1cccc(c1)[C@@H]1CCCN1.Cl
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
260.992g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
262.575g/mol
Monoisotopic Mass:
260.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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