2,5-Dimethoxy-3,4,6-trimethylbenzoic acid

HCID 2752035
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Basic information

CAS
89048-20-4
Standard SMILES
COc1c(C)c(C)c(OC)c(C(=O)O)c1C
InChIKey
UCEUSYURLZSDFH-UHFFFAOYSA-N
Molecular formula
C12H16O4
Average molar mass
224.25 g/mol
Monoisotopic mass
224.10485899

Names & identifiers

Preferred name
2,5-Dimethoxy-3,4,6-trimethylbenzoic acid
IUPAC
2,5-dimethoxy-3,4,6-trimethylbenzoic acid

Names & synonyms

2,5-dimethoxy-3,4,6-trimethylbenzoic acid89048-20-4Benzoic acid, 2,5-dimethoxy-3,4,6-trimethyl-SCHEMBL10474965DTXSID00372870UCEUSYURLZSDFH-UHFFFAOYSA-NAKOS004907080DB-376240

Database identifiers

CAS
89048-20-4
PubChem CID
2752035
DTXSID
DTXSID00372870

Properties

Computed structural propertiesFilling in

XLogP
2.5
Topological polar surface area
55.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
16

Related reactions

5 records
New reaction record

Compound notes

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