AG00IDUC

859854-66-3 | tert-Butyl (trans-3-hydroxypiperidin-4-yl)carbamate

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CAS Number	859854-66-3
Catalog Number	AG00IDUC(AGN-PC-0WBRMM)
Chemical Name	tert-Butyl (trans-3-hydroxypiperidin-4-yl)carbamate
IUPAC Name	tert-butyl N-[(3S,4S)-3-hydroxypiperidin-4-yl]carbamate
InChI	InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-7-4-5-11-6-8(7)13/h7-8,11,13H,4-6H2,1-3H3,(H,12,14)/t7-,8-/m0/s1
InChI Key	MLTCALYMVICSBJ-YUMQZZPRSA-N
MDL Number	MFCD22566134
Molecular Formula	C10H20N2O3
Molecular Weight	216.2774
SMILES	O=C(OC(C)(C)C)N[C@@H]1[C@@H](O)CNCC1
Synonyms	724788-22-1, TERT-BUTYL N-[(3S,4S)-3-HYDROXYPIPERIDIN-4-YL]CARBAMATE, 859854-66-3, tert-Butyl (trans-3-hydroxypiperidin-4-yl)carbamate, Carbamic acid,N-[(3S,4S)-3-hydroxy-4-piperidinyl]-, 1,1-dimethylethyl ester, tert-butyl ((3S,4S)-3-hydroxypiperidin-4-yl)carbamate, tert-butyl N-[(3R,4S)-3-hydroxypiperidin-4-yl]carbamate, TERT-BUTYL N-[(3R,4R)-3-HYDROXYPIPERIDIN-4-YL]CARBAMATE, SCHEMBL2180249, tert-butyl (3S,4S)-3-hydroxypiperidin-4-ylcarbamate, MFCD18834104, MFCD22566134, ZINC39093934, AKOS025290069, FCH3885248, SB11092, CarbaMic acid, [(3S,4S)-3-hydroxy-4-piperidinyl]-, 1,1-diMethylethyl ester (9CI), KS-000004N9, KS-000006U4, (3S,4S)-4-(Boc-amino)piperidin-3-ol, AK172156, CS-0055644, Z1687, (3S,4S)-4-(BOC-AMINO)-3-HYDROXYPIPERIDINE, t-Butyl N-[(3S,4S)-3-hydroxypiperidin-4-yl]carbamate, tert-Butyl N-[(3R,4R)-3-hydroxy-4-piperidyl]carbamate, tert-butylN-[(3R,4S)-3-hydroxypiperidin-4-yl]carbamate, 2-Methyl-2-propanyl [(3S,4S)-3-hydroxy-4-piperidinyl]carbamate, carbamic acid,[(3s,4s)-3-hydroxy-4-piperidinyl]-,1,1-dimethylethyl ester, Carbamic acid, [(3S,4S)-3-hydroxy-4-piperidinyl]-, 1,1-dimethylethyl ester, C10H20N2O3, TRANS-4-(BOC-AMINO)-3-HYDROXYPIPERIDINE, Carbamicacid,[ -3-hydroxy-4-piperidinyl]-,1,1-dimethylethylester, 642478-29-3, 724788-29-8,

Complexity	225
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	216.147g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	216.281g/mol
Monoisotopic Mass	216.147g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	70.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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