3-Tert-butyl-4-isopropyloxybenzoyl chloride

HCID 21474493
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Basic information

Standard SMILES
CC(C)Oc1ccc(C(=O)Cl)cc1C(C)(C)C
InChIKey
YEMQALVBHQSSNL-UHFFFAOYSA-N
Molecular formula
C14H19ClO2
Average molar mass
254.75 g/mol

Names & identifiers

Preferred name
3-Tert-butyl-4-isopropyloxybenzoyl chloride
IUPAC
3-tert-butyl-4-propan-2-yloxybenzoyl chloride

Names & synonyms

142651-37-4SCHEMBL8839112YEMQALVBHQSSNL-UHFFFAOYSA-NDA-232203-tert-butyl-4-isopropyloxybenzoyl chloride

Database identifiers

PubChem CID
21474493

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
17

Related reactions

3 records
New reaction record

Compound notes

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