Basic information
- CAS
100311-30-6- Standard SMILES
CCCc1cc(C(=O)O)cc(CCC)c1OCC(=O)O- InChIKey
RJDFLXSAVMILLO-UHFFFAOYSA-N- Molecular formula
- C15H20O5
- Average molar mass
- 280.32 g/mol
- Monoisotopic mass
- 280.13107373
Names & identifiers
- Preferred name
- Benzoic acid, 4-(carboxymethoxy)-3,5-dipropyl-
- IUPAC
- 4-(carboxymethoxy)-3,5-dipropylbenzoic acid
- English name
- 4-(Carboxymethoxy)-3,5-dipropylbenzoic acid
- Molecular weight
- 0
Names & synonyms
4-(Carboxymethoxy)-3,5-dipropylbenzoic acid100311-30-6BENZOIC ACID, 4-(CARBOXYMETHOXY)-3,5-DIPROPYL-BRN 2596464DTXSID70143150RefChem:327487DTXCID5065641
Database identifiers
- CAS
100311-30-6- PubChem CID
- 57762
- DTXSID
DTXSID70143150- Nikkaji
- J73.912J
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 312
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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