3-Cyclohexene-1-carboxylic acid, methyl ester

Catalog Number	ACM6493772-1
CAS	6493-77-2
Structure
IUPAC Name	methyl cyclohex-3-ene-1-carboxylate
Synonyms	6493-77-2;Methyl cyclohex-3-enecarboxylate;methyl cyclohex-3-ene-1-carboxylate;3-Cyclohexene-1-carboxylic Acid Methyl Ester;3-Cyclohexene-1-carboxylic acid, methyl ester;Methyl 3-cyclohexenecarboxylate;Methyl 3-cyclohexene-1-carboxylate;1-Carbomethoxy-3-cyclohexene;Methyl 4-cyclohexenecarboxylate;Methyl 1,2,3,6-tetrahydrobenzoate;1,3-Butadiene-methyl acrylate adduct;methyl (S)-cyclohex-3-ene-1-carboxylate;Methyl 3-cyclohexenecarboxylate, 97%;3-CYCLOHEXENE-1-CARBOXYLICACIDMETHYLESTER;EINECS 229-376-6;ACMC-1BITY;AI3-28337;SCHEMBL91215;methyl 3-cyclohexene carboxylate;DTXSID30884315;Methyl 1,3,6-tetrahydrobenzoate;Methyl-3-cyclohexene-1-carboxylate;NSC93912;9933AB;ANW-34966;MFCD00053266;NSC-93912;SBB007742;AKOS006229745;3-Cyclohexene-1-carboxylic acid methyl;NE11071;PS-11883;FT-0615563;ST50828257;Methyl ester of 3-cyclohexene-1-carboxylic acid;CYCLOHEXENE-4-CARBOXYLIC ACID METHYL ESTER
Molecular Weight	140.18g/mol
Molecular Formula	C8H12O2
Canonical SMILES	COC(=O)C1CCC=CC1
InChI	InChI=1S/C8H12O2/c1-10-8(9)7-5-3-2-4-6-7/h2-3,7H,4-6H2,1H3
InChI Key	IPUNVLFESXFVFH-UHFFFAOYSA-N
Complexity	149
Covalently-Bonded Unit Count	1
EC Number	229-376-6
Exact Mass	140.083729621g/mol
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Monoisotopic Mass	140.083729621g/mol
NSC Number	93912
Rotatable Bond Count	2
Topological Polar Surface Area	26.3Å²
X Log P3	1.6

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