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1392208-60-4 | 3-Pyrrolidinecarboxylic acid, 4-(3-methoxyphenyl)-, hydrochloride (1:1), (3R,4S)-rel-
CAS No: 1392208-60-4 Catalog No: AG001AHO MDL No:
Product Description
Catalog Number:
AG001AHO
Chemical Name:
3-Pyrrolidinecarboxylic acid, 4-(3-methoxyphenyl)-, hydrochloride (1:1), (3R,4S)-rel-
CAS Number:
1392208-60-4
IUPAC Name:
(3R,4S)-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C12H15NO3.ClH/c1-16-9-4-2-3-8(5-9)10-6-13-7-11(10)12(14)15;/h2-5,10-11,13H,6-7H2,1H3,(H,14,15);1H/t10-,11+;/m1./s1
InChI Key:
WZTOARBQRXVWBQ-DHXVBOOMSA-N
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
257.082g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
257.714g/mol
Monoisotopic Mass:
257.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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