AG003HSL

4883-67-4 | 2-Nitrocyclohexanone

AG003HSL

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CAS Number	4883-67-4
Catalog Number	AG003HSL(AGN-PC-0JS9XC)
Chemical Name	2-Nitrocyclohexanone
IUPAC Name	2-nitrocyclohexan-1-one
InChI	InChI=1S/C6H9NO3/c8-6-4-2-1-3-5(6)7(9)10/h5H,1-4H2
InChI Key	SZNILIWUUKKNPE-UHFFFAOYSA-N
MDL Number	MFCD00001627
Molecular Formula	C6H9NO3
Molecular Weight	143.1406
SMILES	O=C1C([N+]([O-])=O)CCCC1
Synonyms	2-nitrocyclohexanone, 2-Nitrocyclohexanone, 4883-67-4, Cyclohexanone, 2-nitro-, 2-nitro-cyclohexanone, 2-nitrocyclohexan-1-one, .alpha.-Nitrocyclohexanone, SZNILIWUUKKNPE-UHFFFAOYSA-N, nitrocyclohexanone, ACMC-20anoz, AC1LAVBU, 2-nitro-cyclohexan-1-one, 2-Nitrocyclohexanone, 99%, SCHEMBL2159399, CTK1D5271, DTXSID50334589, AKOS005137917, QC-8583, RP20816, AB0097349, TX-010025, Z-9442, J-510175, I14-21234, 2-chlorothiazole-4-carboxylic acid, CID521241, Cyclohexanone, 2-nitro- (6CI, 7CI, 8CI, 9CI),

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.058g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	143.142g/mol
Monoisotopic Mass	143.058g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	62.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number