AG0061BD

68776-60-3 | Oxazole-2-carbonitrile

AG0061BD

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CAS Number	68776-60-3
Catalog Number	AG0061BD(AGN-PC-02KEKQ)
Chemical Name	Oxazole-2-carbonitrile
IUPAC Name	1,3-oxazole-2-carbonitrile
InChI	InChI=1S/C4H2N2O/c5-3-4-6-1-2-7-4/h1-2H
InChI Key	UUAXDPHPSHEGQQ-UHFFFAOYSA-N
MDL Number	MFCD08669511
Molecular Formula	C4H2N2O
Molecular Weight	94.0715
SMILES	N#CC1=NC=CO1
Synonyms	Oxazole-2-carbonitrile, 68776-60-3, 2-Cyano-oxazole, 2-OXAZOLECARBONITRILE, 2-cyanooxazole, 1,3-oxazole-2-carbonitrile, cyanooxazole, AMOT0349, CTK1J1748, DTXSID30600193, UUAXDPHPSHEGQQ-UHFFFAOYSA-N, 0624AC, FCH835105, MFCD08669511, ZINC44137937, AKOS006282958, AM85873, AB0075647, AJ-109410, AX8077888, DB-003744, FT-0732422, A-2496, C4H2N2O, ACN-001824,

Complexity	104
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	94.017g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	94.073g/mol
Monoisotopic Mass	94.017g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H300-H311+H331
Packing Group	Ⅲ
Precautionary statements	P261-P264-P280-P301+P310
UN Code	UN 2810

Certificate of Analysis

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