AG003090

3047-38-9 | 1-Cyclopentene-1-carbonitrile

AG003090

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CAS Number	3047-38-9
Catalog Number	AG003090(AGN-PC-0JMPPF)
Chemical Name	1-Cyclopentene-1-carbonitrile
IUPAC Name	cyclopentene-1-carbonitrile
InChI	InChI=1S/C6H7N/c7-5-6-3-1-2-4-6/h3H,1-2,4H2
InChI Key	XBVZRFXCDCYXAX-UHFFFAOYSA-N
MDL Number	MFCD00043765
Molecular Formula	C6H7N
Molecular Weight	93.1265
SMILES	N#CC1CCCC=1
Synonyms	3047-38-9, 1-Cyanocyclopentene, cyclopent-1-enecarbonitrile, 1-Cyclopentene-1-carbonitrile, 1-Cyclopentenecarbonitrile, cyclopent-1-ene-1-carbonitrile, 1-cyano-1-cyclopentene, cyclopentene-1-carbonitrile, MFCD00043765, 1-Cyanocyclopenten, ACMC-20aovl, 1-Cyclopentenyl cyanide, AC1L3BEV, 1 - Cyclopentenecarbonitrile, CTK1C4916, DTXSID90184545, ZINC2584532, 3193AB, SBB007727, AKOS006229630, FR-0201, NE43060, AJ-43458, SC-50518, DB-081001, ST2406758, TR-013092, CS-0089734, FT-0607665, J-017971, I14-94091, F9995-1512, C6H7N, CID137808,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	93.058g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	93.129g/mol
Monoisotopic Mass	93.058g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302+H312-H315-H319-H331-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338-P311
UN Code	UN 3276

Certificate of Analysis

Lot Number