AG003C4Z

397246-14-9 | (R)-(+)-2-(Boc-Amino)-1,4-butanediol

AG003C4Z

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CAS Number	397246-14-9
Catalog Number	AG003C4Z(AGN-PC-0RKL0G)
Chemical Name	(R)-(+)-2-(Boc-Amino)-1,4-butanediol
IUPAC Name	tert-butyl N-[(2R)-1,4-dihydroxybutan-2-yl]carbamate
InChI	InChI=1S/C9H19NO4/c1-9(2,3)14-8(13)10-7(6-12)4-5-11/h7,11-12H,4-6H2,1-3H3,(H,10,13)/t7-/m1/s1
InChI Key	KLRRFBSWOIUAHZ-SSDOTTSWSA-N
MDL Number	MFCD08703679
Molecular Formula	C9H19NO4
Molecular Weight	205.2515
SMILES	O=C(OC(C)(C)C)N[C@H](CCO)CO
Synonyms	397246-14-9, (R)-(+)-2-(Boc-Amino)-1,4-butanediol, (R)-tert-Butyl (1,4-dihydroxybutan-2-yl)carbamate, (R)-2-Boc-Amino-Butane-1,4-Diol, (R)-(+)-2-(BOC-Amino)-1,4-butanediol, 97%, AK-39997, PubChem15259, KSC498C9F, SCHEMBL2617386, [(1R)-3-Hydroxy-1-(hydroxymethyl)propyl]carbamic acid tert-butyl ester, CTK3J8192, DTXSID60474647, ACN-S003507, ZINC5018745, ANW-52383, CB0023, MFCD08703679, (R)-2-(Boc-amino)-1,4-butanediol, AKOS016842382, CB-1858, CS-W019173, FCH3506717, RTR-015860, ACM397246149, AJ-52955, BR-39997, CJ-12397, DS-13186, AB0033452, AX8119922, TR-015860, AM20120600, FT-0689042, ST24026461, X7004, (R)-2-(BOC-AMINO)-BUTAN-1,4-DIOL, S-2322, (2R)-(tert-Butoxycarbonylamino)butane-1,4-diol, (r)-tert-butyl 1,4-dihydroxybutan-2-ylcarbamate, 246B149, ((R)-3-Hydroxy-1-hydroxymethyl-propyl)-carbamic ac, tert-butyl (R)-(1,4-dihydroxybutan-2-yl)carbamate, I14-14059, TERT-BUTYL N-[(2R)-1,4-DIHYDROXYBUTAN-2-YL]CARBAMATE, [(1R)-3-Hydroxy-1-(hydroxymethyl)propyl]carbamic acid tert-butyl ester, AldrichCPR, C9H19NO4, ZINC02506798, ACN-037859, CB11504, CID11954482, Carbamic acid, [(1R)-3-hydroxy-1-(hydroxymethyl)propyl]-, 1,1-dimethylethyl,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	205.131g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	205.254g/mol
Monoisotopic Mass	205.131g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	78.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number