AG004C8F

88466-74-4 | (S)-1-((Benzyloxy)carbonyl)piperidine-3-carboxylic acid

AG004C8F

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CAS Number	88466-74-4
Catalog Number	AG004C8F(AGN-PC-0OLPJS)
Chemical Name	(S)-1-((Benzyloxy)carbonyl)piperidine-3-carboxylic acid
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
MDL Number	MFCD04114968
Molecular Formula	C14H17NO4
Molecular Weight	263.2891
SMILES	O=C([C@@H]1CN(C(OCC2=CC=CC=C2)=O)CCC1)O
Synonyms	88466-74-4, (s)-1-cbz-piperidine-3-carboxylic acid, (s)-piperidine-1,3-dicarboxylic acid 1-benzyl ester, (S)-1-((Benzyloxy)carbonyl)piperidine-3-carboxylic acid, L-1-Cbz-Nipecotic acid, (3S)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid, (3S)-1-[(benzyloxy)carbonyl]piperidine-3-carboxylic acid, AC1LEICS, (S)-1-(benzyloxycarbonyl)piperidine-3-carboxylic acid, (S)-1-Cbz-Nip-OH, (s)-1-cbz-nipecotic acid, 1,3-Piperidinedicarboxylicacid, 1-(phenylmethyl) ester, (3S)-, SCHEMBL3277860, CTK5F9973, FFLPIVZNYJKKDM-LBPRGKRZSA-N, ZINC159020, 4146AC, ANW-73622, MFCD04114968, AKOS015836882, AKOS015897778, PB32374, 1-Cbz-(3S)-3-piperidinecarboxylic acid, 1-n-cbz-piperidine-3(s)-carboxylic acid, AJ-15445, TR-027794, CS-0053786, FT-0642089, Q-1065, I12-0276, Q-103063, (3S)-1-Benzyloxycarbonylpiperidine-3-carboxylic acid, cc-467, C14H17NO4, NSC34059, (S)-1-Cbz-piperidine-3-carboxylicacid, CID736539, ACN-031070, -PIPERIDINE-1,3-DICARBOXYLICACID1-BENZYLESTER, 1,3-PIPERIDINEDICARBOXYLIC ACID, 1-(PHENYLMETHYL) ESTER, (3S)-,

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

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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