11-(1-Carboxycyclobutyl)-2,2-dimethyl-7-oxoundecanoic acid

HCID 11645559
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Basic information

Standard SMILES
CC(C)(CCCCC(=O)CCCCC1(C(=O)O)CCC1)C(=O)O
InChIKey
RPGBUFAEKZRJQO-UHFFFAOYSA-N
Molecular formula
C18H30O5
Average molar mass
326.4 g/mol

Names & identifiers

Preferred name
11-(1-Carboxycyclobutyl)-2,2-dimethyl-7-oxoundecanoic acid
IUPAC
1-(10-carboxy-10-methyl-5-oxoundecyl)cyclobutane-1-carboxylic acid

Names & synonyms

SCHEMBL3280690RPGBUFAEKZRJQO-UHFFFAOYSA-N11-(1-Carboxycyclobutyl)-2,2-dimethyl-7-oxoundecanoic acid

Database identifiers

PubChem CID
11645559

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
91.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
12
Heavy atoms
23

Related reactions

5 records
New reaction record

Compound notes

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