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88466-74-4 | (S)-1-((Benzyloxy)carbonyl)piperidine-3-carboxylic acid
CAS No: 88466-74-4 Catalog No: AG004C8F MDL No:MFCD04114968
Product Description
Catalog Number:
AG004C8F
Chemical Name:
(S)-1-((Benzyloxy)carbonyl)piperidine-3-carboxylic acid
CAS Number:
88466-74-4
Molecular Formula:
C14H17NO4
Molecular Weight:
263.2891
MDL Number:
MFCD04114968
IUPAC Name:
(3S)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid
InChI:
InChI=1S/C14H17NO4/c16-13(17)12-7-4-8-15(9-12)14(18)19-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,17)/t12-/m0/s1
InChI Key:
FFLPIVZNYJKKDM-LBPRGKRZSA-N
SMILES:
OC(=O)[C@H]1CCCN(C1)C(=O)OCc1ccccc1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
263.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.293g/mol
Monoisotopic Mass:
263.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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