AG002UMG

27741-65-7 | Acetic acid, 2-​cyclobutylidene-​, ethyl ester

AG002UMG

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CAS Number	27741-65-7
Catalog Number	AG002UMG(AGN-PC-0NKS2I)
Chemical Name	Acetic acid, 2-​cyclobutylidene-​, ethyl ester
IUPAC Name	ethyl 2-cyclobutylideneacetate
InChI	InChI=1S/C8H12O2/c1-2-10-8(9)6-7-4-3-5-7/h6H,2-5H2,1H3
InChI Key	FGCGWHVDPBOFJE-UHFFFAOYSA-N
MDL Number	MFCD11977311
Molecular Formula	C8H12O2
Molecular Weight	140.1797
SMILES	C(=C1CCC1)C(=O)OCC
Synonyms	ethyl 2-cyclobutylideneacetate, 27741-65-7, Ethyl Cyclobutylideneacetate, Cyclobutylidene-acetic acid ethyl ester, Acetic acid, cyclobutylidene-, ethyl ester, Aceticacid, 2-cyclobutylidene-, ethyl ester, Acetic acid, 2-cyclobutylidene-, ethyl ester, ethyl 2-cyclobutylideneethanoate, SCHEMBL1668850, CTK4G0200, DTXSID10577455, FGCGWHVDPBOFJE-UHFFFAOYSA-N, KS-000019JF, ANW-59723, MFCD11977311, RB3329, SBB054044, ZINC34728784, Cyclobutylideneacetic acid ethyl ester, AKOS016003746, MCULE-8612971671, 2-cyclobutylideneacetic acid ethyl ester, AJ-90005, AK-39259, DS-13105, DB-011543, TC-148468, 4CH-021624, CS-0038534, FT-0696401, ST24046856, Z-2417, A819176, Z1397149963, Ethyl2-cyclobutylideneacetate, 143140-39-0,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.084g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	140.182g/mol
Monoisotopic Mass	140.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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