733742-70-6
TRANS-2-(2-METHYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID
Name
TRANS-2-(2-METHYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID
Formula
C15 H18 O3
MolWeight
246.304
1Identification
【Name】
TRANS-2-(2-METHYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD01311268
【English Synonyms】
【Formula】
C15 H18 O3
【MolWeight】
246.304
【Inchi】
InChI=1S/C15H18O3/c1-10-6-2-3-7-11(10)14(16)12-8-4-5-9-13(12)15(17)18/h2-3,6-7,12-13H,4-5,8-9H2,1H3,(H,17,18)/t12-,13-/m1/s1
【InChIKey】
InChIKey=FZGOZGATZZWODF-CHWSQXEVSA-N
【SMILES】
Cc1ccccc1C(=O)[C@@H]2CCCC[C@H]2C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TRANS-2-(2-METHYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID.cml
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Catalog No:CHM0070231 1G
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Catalog No:201187-10G 10G
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