Cas no 99807-54-2 (4-(Bromomethyl)-α-methyl-benzeneacetic Acid Methyl Ester)

4-(Bromomethyl)-α-methyl-benzeneacetic Acid Methyl Ester structure
99807-54-2 structure
Product Name:4-(Bromomethyl)-α-methyl-benzeneacetic Acid Methyl Ester
CAS No:99807-54-2
MF:C11H13BrO2
MW:257.123722791672
CID:4744409
Update Time:2023-11-22

4-(Bromomethyl)-α-methyl-benzeneacetic Acid Methyl Ester Chemical and Physical Properties

Names and Identifiers

    • 2-(4-BROMOMETHYLPHENYL)PROPIONIC ACID METHYL ESTER
    • Methyl 2-[4-(bromomethyl)phenyl]propanoate
    • methyl 2-(4-(bromomethyl)phenyl)propanoate
    • Methyl 2-(4-bromomethylphenyl)propanoate
    • methyl 2-(4-bromomethylphenyl)propionate
    • Methyl=2-[4-(bromomethyl)phenyl]propanoate
    • 2-(4-bromomethyl-phenyl)-propionic acid methyl ester
    • methyl 4-(bromomethy) phenyl acetic acid methyl ester
    • 4-(Bromomethyl)-α-methyl-benzeneacetic Acid Methyl Ester
    • Inchi: 1S/C11H13BrO2/c1-8(11(13)14-2)10-5-3-9(7-12)4-6-10/h3-6,8H,7H2,1-2H3
    • InChI Key: OXFCILAOEGBINA-UHFFFAOYSA-N
    • SMILES: BrCC1C=CC(=CC=1)C(C(=O)OC)C

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 186
  • XLogP3: 2.8
  • Topological Polar Surface Area: 26.3

Experimental Properties

  • Density: 1.360±0.06 g/cm3(Predicted)
  • Boiling Point: 298.6±20.0 °C(Predicted)

4-(Bromomethyl)-α-methyl-benzeneacetic Acid Methyl Ester Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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B890440-250mg
4-(Bromomethyl)-α-methyl-benzeneacetic Acid Methyl Ester
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$ 167.00 2023-04-18
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$ 100.00 2023-09-08
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B890440-500mg
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$ 450.00 2023-09-08
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Enamine
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