4-(Chloromethyl)-6-(1,1-dimethylethyl)-2H-1-benzopyran-2-one

CAS Registry Number®

41295-61-8
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CAS Name

4-(Chloromethyl)-6-(1,1-dimethylethyl)-2H-1-benzopyran-2-one

Molecular Formula

C14H15ClO2

Molecular Mass

250.72

Cite this Page

4-(Chloromethyl)-6-(1,1-dimethylethyl)-2H-1-benzopyran-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=41295-61-8 (retrieved 2024-08-17) (CAS RN: 41295-61-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    134-135 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H15ClO2/c1-14(2,3)10-4-5-12-11(7-10)9(8-15)6-13(16)17-12/h4-7H,8H2,1-3H3

InChIKey

InChIKey=LDRHULNLHRCWAE-UHFFFAOYSA-N

SMILES

C(Cl)C=1C=2C(=CC=C(C(C)(C)C)C2)OC(=O)C1

Canonical SMILES

O=C1OC=2C=CC(=CC2C(=C1)CCl)C(C)(C)C

Other Names for this Substance

  • 2H-1-Benzopyran-2-one, 4-(chloromethyl)-6-(1,1-dimethylethyl)-
  • 4-(Chloromethyl)-6-(1,1-dimethylethyl)-2H-1-benzopyran-2-one
  • 6-tert-Butyl-4-(chloromethyl)coumarin