CAS
103859-86-5 Purity
97%
103859-86-5 Purity
97%
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Trans-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid
CAS
1049975-91-8
Catalog Number
ACM1049975918-1
Category
Chiral Molecules
Molecular Weight
209.22
Molecular Formula
C11H12FNO2
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Specification
Synonyms
Rac-(3R,4S)-4-(2-Fluorophenyl)pyrrolidine-3-carboxylic acid
IUPAC Name
(3S,4R)-4-(2-Fluorophenyl)pyrrolidine-3-carboxylic acid
Canonical SMILES
C1C(C(CN1)C(=O)O)C2=CC=CC=C2F
InChI
InChI=1S/C11H12FNO2/c12-10-4-2-1-3-7(10)8-5-13-6-9(8)11(14)15/h1-4,8-9,13H,5-6H2,(H,14,15)/t8-,9+/m0/s1
InChI Key
YVTADGCUSGBFIQ-DTWKUNHWSA-N
Complexity
247
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
209.08520679
Heavy Atom Count
15
Isomeric SMILES
C1[C@H]([C@@H](CN1)C(=O)O)C2=CC=CC=C2F
Monoisotopic Mass
209.08520679
Physical State
Solid
Topological Polar Surface Area
49.3 Ų
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