99070-17-4
3-BROMO-4-ISOPROPYLBENZOIC ACID
Name
3-BROMO-4-ISOPROPYLBENZOIC ACID
Formula
C10 H11 Br O2
MolWeight
243.099
1Identification
【Name】
3-BROMO-4-ISOPROPYLBENZOIC ACID
【CAS】
741698-94-2
;99070-17-4
【MDL】
MFCD11110860
【English Synonyms】
【Formula】
C10 H11 Br O2
【MolWeight】
243.099
【Inchi】
InChI=1S/C10H11BrO2/c1-6(2)8-4-3-7(10(12)13)5-9(8)11/h3-6H,1-2H3,(H,12,13)
【InChIKey】
InChIKey=VLOPEDMMJXCNSH-UHFFFAOYSA-N
【SMILES】
CC(C)c1ccc(cc1Br)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3-BROMO-4-ISOPROPYLBENZOIC ACID.cml
Quick Release
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Catalog No:A5829 1G
Country/Region:United States
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