Methyl 4-Bromobenzoate
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Product Description
Product
Methyl 4-Bromobenzoate
CAS
619-42-1
Formula
C8H7BrO2
Synonym
Methyl 4-bromobenzoate; methyl p-bromobenzoate; NSC 9392; p-Bromobenzoic acid, methyl ester; UNII-UB1YSJ5XAR; 4-Bromobenzoic acid, methyl ester; Benzoic acid, 4-bromo-, methyl ester; Benzoic acid, p-bromo-, methyl ester; Benzoic acid, p-bromo-, methyl ester (8CI); EINECS 210-596-6
Typical Product Specifications
Molecular weight
215.04
SMILES
c1(ccc(Br)cc1)C(OC)=O
InChI
1S/C8H7BrO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey
CZNGTXVOZOWWKM-UHFFFAOYSA-N
Water solubility
111 mg/L
Henry's Law Constant
1.38E-05 atm-m3/mole
Atmospheric OH Rate Constant
6.12E-13 cm3/molecule-sec
log P (octanol-water)
2.95
Vapor Pressure
0.025 mm Hg
Melting Point
81 ° C
Class
Methyl 4-Bromobenzoate
Product Description
Product
Methyl 4-Bromobenzoate
CAS
619-42-1
Formula
C8H7BrO2
Synonym
Methyl 4-bromobenzoate; methyl p-bromobenzoate; NSC 9392; p-Bromobenzoic acid, methyl ester; UNII-UB1YSJ5XAR; 4-Bromobenzoic acid, methyl ester; Benzoic acid, 4-bromo-, methyl ester; Benzoic acid, p-bromo-, methyl ester; Benzoic acid, p-bromo-, methyl ester (8CI); EINECS 210-596-6
Typical Product Specifications
Molecular weight
215.04
SMILES
c1(ccc(Br)cc1)C(OC)=O
InChI
1S/C8H7BrO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey
CZNGTXVOZOWWKM-UHFFFAOYSA-N
Water solubility
111 mg/L
Henry's Law Constant
1.38E-05 atm-m3/mole
Atmospheric OH Rate Constant
6.12E-13 cm3/molecule-sec
log P (octanol-water)
2.95
Vapor Pressure
0.025 mm Hg
Melting Point
81 ° C
Class
