AG006J98

68498-54-4 | Cyclopentylisocyanide

AG006J98

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CAS Number	68498-54-4
Catalog Number	AG006J98(AGN-PC-0KK6QK)
Chemical Name	Cyclopentylisocyanide
IUPAC Name	isocyanocyclopentane
InChI	InChI=1S/C6H9N/c1-7-6-4-2-3-5-6/h6H,2-5H2
InChI Key	XTLSDEJNOQVCHL-UHFFFAOYSA-N
MDL Number	MFCD02664624
Molecular Formula	C6H9N
Molecular Weight	95.1424
SMILES	[C-]#[N+]C1CCCC1
Synonyms	cyclopentyl isocyanide, Cyclopentylisocyanide, 68498-54-4, Isocyanocyclopentane, GEO-02903, Cyclopentyl isocyanide, 96%, Isocyano-cyclopentan, Isocyano-cyclopentane, cyclopentyl isonitrile, 3-Isocyano-cyclopentane, ACMC-1BGSW, AC1MC1XB, CTK2F2591, TOS-BB-0762, DTXSID50370503, XTLSDEJNOQVCHL-UHFFFAOYSA-N, MFCD02664624, ZINC95713386, AKOS007930589, FCH1122466, SC-21685, TC-167319, FT-0693426, CID2734784, C2959,

Complexity	92
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	95.073g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	95.145g/mol
Monoisotopic Mass	95.073g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	4.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H315-H319
Packing Group	Ⅲ
Precautionary statements	P261-P264-P270-P271-P280-P312-P363-P501
Signal Words	warning
UN Code	UN 2810

Certificate of Analysis

Lot Number