57821-78-0
4-OXO-4-(4-PROPYLPHENYL)BUTANOIC ACID
Name
4-OXO-4-(4-PROPYLPHENYL)BUTANOIC ACID
Formula
C13 H16 O3
MolWeight
220.266
1Identification
【Name】
4-OXO-4-(4-PROPYLPHENYL)BUTANOIC ACID
【CAS】
【MDL】
MFCD00173765
【English Synonyms】
【Formula】
C13 H16 O3
【MolWeight】
220.266
【Inchi】
InChI=1S/C13H16O3/c1-2-3-10-4-6-11(7-5-10)12(14)8-9-13(15)16/h4-7H,2-3,8-9H2,1H3,(H,15,16)
【InChIKey】
InChIKey=ARAPWKABKMIXFP-UHFFFAOYSA-N
【SMILES】
CCCc1ccc(cc1)C(=O)CCC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
Oakwood Products, Inc. :4-OXO-4-(4-PROPYLPHENYL)BUTANOIC ACID
4CML File
4-OXO-4-(4-PROPYLPHENYL)BUTANOIC ACID.cml
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