AG00D94A

478646-33-2 | Benzyl N-[(3S)-piperidin-3-yl]carbamate

AG00D94A

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CAS Number	478646-33-2
Catalog Number	AG00D94A(AGN-PC-0OAQIG)
Chemical Name	Benzyl N-[(3S)-piperidin-3-yl]carbamate
IUPAC Name	benzyl N-[(3S)-piperidin-3-yl]carbamate
InChI	InChI=1S/C13H18N2O2/c16-13(15-12-7-4-8-14-9-12)17-10-11-5-2-1-3-6-11/h1-3,5-6,12,14H,4,7-10H2,(H,15,16)/t12-/m0/s1
InChI Key	GEHZGURGZRSODK-LBPRGKRZSA-N
MDL Number	MFCD03426377
Molecular Formula	C13H18N2O2
Molecular Weight	234.2942
SMILES	O=C(N[C@@H]1CNCCC1)OCC2=CC=CC=C2
Synonyms	478646-33-2, (S)-benzyl piperidin-3-ylcarbamate, (s)-3-n-cbz-aminopiperidine, (S)-3-N-Cbz-Amino-piperidine, benzyl N-[(3S)-piperidin-3-yl]carbamate, (S)-Piperidin-3-yl-carbamic acid benzyl ester, (s)-3-(cbz-amino)piperidine, benzyl (3S)-piperidin-3-ylcarbamate, PubChem15197, (s)-3-cbz-aminopiperidine, AC1LTT10, SCHEMBL3295234, (s)-3-n-cbz-3-aminopiperidine, CTK8D4054, DTXSID90363797, benzyl(s)-piperidin-3-ylcarbamate, GEHZGURGZRSODK-LBPRGKRZSA-N, benzyl (S)-piperidin-3-ylcarbamate, KS-000007MT, ZINC4202834, Benzyl (3S)-3-piperidinylcarbamate, MFCD03426377, AKOS015855403, CC-1051, PB21229, RTC-070505, (3S)-3-benzyloxycarbonylaminopiperidine, AJ-48521, AM100866, AS-37282, BR-51623, (S)-3-N-cbz-amino-piperidine, AldrichCPR, AB0025057, ST2414656, TC-070505, CS-0049804, FT-0660404, W6449, S-6843, I14-4401, Benzyl N-(3-piperidyl)carbamate, C13H18N2O2, -3-N-CBZ-AMINO-PIPERIDINE, benzyl N-(piperidin-3-yl)carbamate, ACN-031081, CB10291, CID1514175, benzyl N-[(3R)-piperidin-3-yl]carbamate, A13408, (S)-3-N-Cbz-aminopiperidine, 97% - 1G 1g, CARBAMIC ACID, N-(3S)-3-PIPERIDINYL-, PHENYLMETHYL ESTER, 31648-54-1, 478646-32-1,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	234.137g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	234.299g/mol
Monoisotopic Mass	234.137g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	50.4A^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	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

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