AG0037GV

41088-52-2 | Methyl 3,4-epoxycyclohexane carboxylate

AG0037GV

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CAS Number	41088-52-2
Catalog Number	AG0037GV(AGN-PC-0NK7EJ)
Chemical Name	Methyl 3,4-epoxycyclohexane carboxylate
IUPAC Name	methyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate
InChI	InChI=1S/C8H12O3/c1-10-8(9)5-2-3-6-7(4-5)11-6/h5-7H,2-4H2,1H3
InChI Key	QCGKUFZYSPBMAY-UHFFFAOYSA-N
MDL Number	MFCD13185927
Molecular Formula	C8H12O3
Molecular Weight	156.1791
SMILES	O1C2CC(CCC21)C(=O)OC
Synonyms	41088-52-2, Methyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, 3,4-Epoxycyclohexanecarboxylic acid methyl ester, methyl 3,4-epoxycyclohexane carboxylate, 3,4-Epoxycyclohexane carboxylic acid, methyl ester, 7-Oxabicyclo(4.1.0)heptane-3-carboxylic acid, methyl ester, 7-Oxabicyclo[4.1.0]heptane-3-carboxylic acid, methyl ester, 7-OXABICYCLO[4.1.0]HEPTANE-3-CARBOXYLIC ACID METHYL ESTER, methyl 3,4-epoxy-1-cyclohexanecarboxylate, PubChem21984, SCHEMBL668029, CTK4I4241, QCGKUFZYSPBMAY-UHFFFAOYSA-N, 5628AB, MFCD13185927, AKOS015901832, methyl 3,4-epoxycyclohexanecarboxylate, DS-4341, FCH1140849, AK109457, methyl-3',4'-epoxycyclohexane carboxylate, AX8225318, FT-0686461, ST24048064, 088E522, 3,4-Epoxycyclohexane-1-carboxylic acid methyl ester, Methyl 7-Oxabicyclo[4.1.0]Heptane-3-Carboxyla..., I14-14590, C8H12O3, C8-H12-O3, 1-(Tricyclohexylstannyl)-1H-1,2,4-triazole, 3,4-Epoxycyclohexanecarboxylicacid,methylester,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	156.079g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	156.181g/mol
Monoisotopic Mass	156.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.8A^2
Undefined Atom Stereocenter Count	3
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

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

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