AG00CMSG

42116-56-3 | tert-butyl 3-hydrazinyl-3-oxopropylcarbaMate

AG00CMSG

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CAS Number	42116-56-3
Catalog Number	AG00CMSG(AGN-PC-08XZR6)
Chemical Name	tert-butyl 3-hydrazinyl-3-oxopropylcarbaMate
IUPAC Name	tert-butyl N-(3-hydrazinyl-3-oxopropyl)carbamate
InChI	InChI=1S/C8H17N3O3/c1-8(2,3)14-7(13)10-5-4-6(12)11-9/h4-5,9H2,1-3H3,(H,10,13)(H,11,12)
InChI Key	IEQUZNXTFVGDPD-UHFFFAOYSA-N
MDL Number	MFCD08689453
Molecular Formula	C8H17N3O3
Molecular Weight	203.2389
SMILES	N(N)C(CCNC(OC(C)(C)C)=O)=O
Synonyms	42116-56-3, tert-Butyl (3-hydrazino-3-oxopropyl)carbamate, tert-butyl (3-hydrazinyl-3-oxopropyl)carbamate, (2-Hydrazinocarbonyl-ethyl)-carbamic acid tert-butyl ester, Boc-beta-Alanine hydrazide, tert-butyl 3-hydrazinyl-3-oxopropylcarbamate, tert-butyl N-(3-hydrazinyl-3-oxopropyl)carbamate, A1-01260, SCHEMBL2384161, ASIS-0219, IEQUZNXTFVGDPD-UHFFFAOYSA-N, ALBB-018223, ZX-AN016909, ZX-AV000243, ZX-CM010158, MFCD08689453, ZINC40448983, AKOS005263927, FCH1318197, MCULE-3682589793, AS-11300, AB0009629, DB-015002, CS-0061011, FT-0734251, EN300-66413, tert-butyl(3-hydrazinyl-3-oxopropyl)carbamate, M-3730, TERT-BUTYL N-[2-(HYDRAZINECARBONYL)ETHYL]CARBAMATE, beta-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-, hydrazide, C8H17N3O3,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.127g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	203.242g/mol
Monoisotopic Mass	203.127g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	93.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H318
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3261

Certificate of Analysis

Lot Number