AG00FGR8

65983-35-9 | 3-(TERT-BUTOXYCARBONYLAMINO)PROPANAMIDE

AG00FGR8

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CAS Number	65983-35-9
Catalog Number	AG00FGR8(AGN-PC-00P7HQ)
Chemical Name	3-(TERT-BUTOXYCARBONYLAMINO)PROPANAMIDE
IUPAC Name	tert-butyl N-(3-amino-3-oxopropyl)carbamate
InChI	InChI=1S/C8H16N2O3/c1-8(2,3)13-7(12)10-5-4-6(9)11/h4-5H2,1-3H3,(H2,9,11)(H,10,12)
InChI Key	MYIHCTNHDMVMEQ-UHFFFAOYSA-N
MDL Number	MFCD09263333
Molecular Formula	C8H16N2O3
Molecular Weight	188.2242
SMILES	O=C(OC(C)(C)C)NCCC(N)=O
Synonyms	65983-35-9, tert-Butyl (3-amino-3-oxopropyl)carbamate, 3-(TERT-BUTOXYCARBONYLAMINO)PROPANAMIDE, N~3~-(tert-Butoxycarbonyl)-beta-alaninamide, tert-butyl N-(3-amino-3-oxopropyl)carbamate, Carbamic acid, (3-amino-3-oxopropyl)-, 1,1-dimethylethyl ester, (2-carbamoyl-ethyl)-carbamic acid tert-butyl ester, SCHEMBL608970, CTK1J5436, DTXSID00572691, 0129AC, ZINC34553173, AKOS006241783, AJ-89297, AS-10015, DB-073688, FT-0743559, Boc-Ala-NH2, C8H16N2O3, MFCD09263333, N-alpha-t-Butyloxycarbonyl-beta-alanine amide, Carbamicacid,(3-amino-3-oxopropyl)-,1,1-dimethylethylester, 85642-13-3,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.116g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	188.227g/mol
Monoisotopic Mass	188.116g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	81.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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