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41302-34-5,MFCD00077699
Catalog No.:AA003HH5
41302-34-5 | Methyl 2-oxocyclohexanecarboxylate
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1g
95%
in stock  
$26.00
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5g
95%
in stock  
$78.00
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10g
95%
in stock  
$133.00
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Technical Information
Catalog Number:
AA003HH5
Chemical Name:
Methyl 2-oxocyclohexanecarboxylate
CAS Number:
41302-34-5
Molecular Formula:
C8H12O3
Molecular Weight:
156.1791
MDL Number:
MFCD00077699
IUPAC Name:
methyl 2-oxocyclohexane-1-carboxylate
InChI:
InChI=1S/C8H12O3/c1-11-8(10)6-4-2-3-5-7(6)9/h6H,2-5H2,1H3
InChI Key:
JEENWEAPRWGXSG-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCCCC1=O
EC Number:
255-306-9
Properties
Computed Properties
 
Complexity:
174  
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:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

Synonyms
 
Methyl 2-oxocyclohexanecarboxylate 
41302-34-5 
Methyl 2-oxocyclohexanecarboxylate, 90% 
2-Oxocyclohexanecarboxylic acid, methyl ester 
EINECS 255-306-9 
PubChem20380 
ACMC-1AO3U 
AC1L55OK 
SCHEMBL3171 
ghl.PD_Mitscher_leg0.110 
2-methoxylcarbonyl cyclohexanone 
2-(Methoxycarbonyl)cyclohexanone 
2-Methoxycarbonylcyclohexanone 
CTK6J0622 
Methyl 2-Cyclohexanonecarboxylate 
Methyl 2-Oxocyclohexylcarboxylate 
methyl-2-oxocyclohexanecarboxylate 
Methyl 2-oxocyclohexanecarboxylate # 
ANW-63725 
MFCD00077699 
AKOS000278431 
AKOS016843258 
Methyl 2-Oxo-1-cyclohexanecarboxylate 
2-Carbomethoxycyclohexanone 
SC11829 
AK-72770 
DS-15245 
SC-49446 
DB-002977 
TX-013431 
2-Oxocyclohexanecarboxylic Acid Methyl Ester 
CS-0054169 
FT-0656468 
2-oxo-cyclohexane-1-carboxylic acid methyl ester 
Methyl cyclohexanone-2-carboxylate 
I14-7201 
S14-1230 
I14-20937 
Methyl 2-oxocyclohexanecarboxylate, technical, >=90% (GC) 
C8H12O3 
C8-H12-O3 
CID170489 
2-Cyclohexanonecarboxylic acid methyl ester 
2-Methoxycarbonylcyclohexanone, 90% - 10ML 10ml 
methyl 2-oxocyclohexane-1-carboxylate 
Cyclohexanecarboxylic acid, 2-oxo-, methyl ester 
JEENWEAPRWGXSG-UHFFFAOYSA-N 
2-OXO-CYCLOHEXANECARBOXYLIC ACID METHYL ESTER 
2-Hydroxy Methyl cyclohexanone 
Literature
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