CAS
99541-27-2 Purity
96%
99541-27-2 Purity
96%
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3-Bromo-4-ethylbenzoic acid
CAS
99548-53-5
Catalog Number
ACM99548535
Category
Other Products
Molecular Weight
229.070560 [g/mol]
Molecular Formula
C9H9BrO2
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Specification
Synonyms
3-bromo-4-ethylbenzoic acid, 99548-53-5, 3-bromo-4-ethyl-benzoic Acid, AC1OIJ74, SureCN3576069, 3-bromanyl-4-ethyl-benzoic acid, CTK8C6764, SBB067754, STK681665, AKOS015842894, MCULE-5456648858, AK-93351, KB-145057, FT-0659015, A846043, I14-5095
IUPAC Name
3-bromo-4-ethylbenzoic acid
Canonical SMILES
CCC1=C(C=C(C=C1)C(=O)O)Br
InChI Key
XUESCTMXEQFNKI-UHFFFAOYSA-N
Exact Mass
227.97900
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 3-bromo-4-ethylbenzoic acid?
The molecular formula of 3-bromo-4-ethylbenzoic acid is C9H9BrO2.
What is the molecular weight of 3-bromo-4-ethylbenzoic acid?
The molecular weight of 3-bromo-4-ethylbenzoic acid is 229.07 g/mol.
What is the IUPAC name of 3-bromo-4-ethylbenzoic acid?
The IUPAC name of 3-bromo-4-ethylbenzoic acid is 3-bromo-4-ethylbenzoic acid.
What is the InChI of 3-bromo-4-ethylbenzoic acid?
The InChI of 3-bromo-4-ethylbenzoic acid is InChI=1S/C9H9BrO2/c1-2-6-3-4-7(9(11)12)5-8(6)10/h3-5H,2H2,1H3,(H,11,12).
What is the InChIKey of 3-bromo-4-ethylbenzoic acid?
The InChIKey of 3-bromo-4-ethylbenzoic acid is XUESCTMXEQFNKI-UHFFFAOYSA-N.
What is the canonical SMILES of 3-bromo-4-ethylbenzoic acid?
The canonical SMILES of 3-bromo-4-ethylbenzoic acid is CCC1=C(C=C(C=C1)C(=O)O)Br.
What is the CAS number of 3-bromo-4-ethylbenzoic acid?
The CAS number of 3-bromo-4-ethylbenzoic acid is 99548-53-5.
What is the European Community (EC) number of 3-bromo-4-ethylbenzoic acid?
The European Community (EC) number of 3-bromo-4-ethylbenzoic acid is 821-661-9.
What is the molecular weight of 3-bromo-4-ethylbenzoic acid according to PubChem?
The molecular weight of 3-bromo-4-ethylbenzoic acid according to PubChem is 229.07 g/mol.
Is 3-bromo-4-ethylbenzoic acid a covalently-bonded unit?
Yes, 3-bromo-4-ethylbenzoic acid is a covalently-bonded unit with a count of 1.
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