AG005WZM

76537-07-0 | 2-Isocyanatofuran

AG005WZM

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CAS Number	76537-07-0
Catalog Number	AG005WZM(AGN-PC-0060YX)
Chemical Name	2-Isocyanatofuran
IUPAC Name	2-isocyanatofuran
InChI	InChI=1S/C5H3NO2/c7-4-6-5-2-1-3-8-5/h1-3H
InChI Key	WGJPTPNEGGRIRA-UHFFFAOYSA-N
MDL Number	MFCD09859828
Molecular Formula	C5H3NO2
Molecular Weight	109.0828
SMILES	O=C=NC1=CC=CO1
Synonyms	2-isocyanatofuran, Furan, 2-isocyanato-, 76537-07-0, 2-furyl isocyanate, 2-furanyl isocyanate, SCHEMBL1647805, CTK2G7630, DTXSID60461133, WGJPTPNEGGRIRA-UHFFFAOYSA-N, ZINC19502690, AKOS000187206, AB53758, CID11286446,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	109.016g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	109.084g/mol
Monoisotopic Mass	109.016g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	42.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1(3)
Hazard statements	H226-H302-H312-H315-H319-H332-H334-H335
Packing Group	Ⅱ
Precautionary statements	P261-P280-P305+P351+P338-P342+P311
UN Code	UN 3080

Certificate of Analysis

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