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855198-27-5
3-BROMO-5-ETHOXYBENZOIC ACID
Name
3-BROMO-5-ETHOXYBENZOIC ACID
Formula
C9 H9 Br O3
MolWeight
245.071
1Identification
【Name】
3-BROMO-5-ETHOXYBENZOIC ACID
【CAS】
【MDL】
MFCD17015802
【English Synonyms】
【Formula】
C9 H9 Br O3
【MolWeight】
245.071
【Inchi】
InChI=1S/C9H9BrO3/c1-2-13-8-4-6(9(11)12)3-7(10)5-8/h3-5H,2H2,1H3,(H,11,12)
【InChIKey】
InChIKey=DMIGIIGQWXKUKM-UHFFFAOYSA-N
【SMILES】
CCOc1cc(cc(c1)Br)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3-BROMO-5-ETHOXYBENZOIC ACID.cml
Quick Release
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