Home Carboxys 5-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylic acid hydrochloride

5-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylic acid hydrochloride

CAS No.:
1803566-20-2
Catalog Number:
AG01ALI3
Molecular Formula:
C12H16ClNO3
Molecular Weight:
257.7133
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Product Description
Catalog Number:
AG01ALI3
Chemical Name:
5-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylic acid hydrochloride
CAS Number:
1803566-20-2
Molecular Formula:
C12H16ClNO3
Molecular Weight:
257.7133
MDL Number:
MFCD28954368
IUPAC Name:
5-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C12H15NO3.ClH/c14-10-4-1-8(2-5-10)7-9-3-6-11(13-9)12(15)16;/h1-2,4-5,9,11,13-14H,3,6-7H2,(H,15,16);1H
InChI Key:
DVOODBANSMELEK-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC(N1)Cc1ccc(cc1)O.Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
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:
4  
Isotope Atom Count:
0
Molecular Weight:
257.714g/mol
Monoisotopic Mass:
257.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties