AG0077HC

1755-04-0 | Bicyclo[3.1.0]hexan-3-one

AG0077HC

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CAS Number	1755-04-0
Catalog Number	AG0077HC(AGN-PC-0JSQ09)
Chemical Name	Bicyclo[3.1.0]hexan-3-one
IUPAC Name	bicyclo[3.1.0]hexan-3-one
InChI	InChI=1S/C6H8O/c7-6-2-4-1-5(4)3-6/h4-5H,1-3H2
InChI Key	WQQZKEFUOHKGII-UHFFFAOYSA-N
MDL Number	MFCD22055042
Molecular Formula	C6H8O
Molecular Weight	96.1271
SMILES	O=C1CC2C(C1)C2
Synonyms	Bicyclo[3.1.0]hexan-3-one, 1755-04-0, WQQZKEFUOHKGII-UHFFFAOYSA-N, AC1LC7EQ, CTK0E3905, DTXSID80338479, AKOS023200051, AK689452, SC-68752, InChI=1/C6H8O/c7-6-2-4-1-5(4)3-6/h4-5H,1-3H, Bicyclo[3,1,0]hexan-3-one, Cis-bicyclo[3.1.0]hexan-3-one, CID549318, ACN-046283,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	96.058g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	96.129g/mol
Monoisotopic Mass	96.058g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H225
Packing Group	Ⅲ
Precautionary statements	P210
UN Code	UN 1993

Certificate of Analysis

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