Deep-Heat
Basic information
- CAS
92172-29-7- Standard SMILES
CCOC(=O)c1ccccc1O.COC(=O)c1ccccc1O.COC(=O)c1cccnc1.O=C(OCCO)c1ccccc1O- InChIKey
FAKNPWOOBCNURP-UHFFFAOYSA-N- Molecular formula
- C33H35NO12
- Average molar mass
- 637.6 g/mol
- Monoisotopic mass
- 637.21592555
Overview
used as topical rubifacient; available in aerosol form; contains methyl nicotinate, 2-hydroxyethyl salicylate, methyl salicylate & ethyl salicylate
Names & identifiers
- Preferred name
- Deep-Heat
- IUPAC
- ethyl 2-hydroxybenzoate;2-hydroxyethyl 2-hydroxybenzoate;methyl 2-hydroxybenzoate;methyl pyridine-3-carboxylate
- English name
- Deep-Heat
- Molecular formula
- C33H35NO12
- Molecular weight
- 637.6305
Names & synonyms
Deep-heat92172-29-7DTXSID302389103-Pyridinecarboxylic acid, methyl ester, mixt. with ethyl 2-hydroxybenzoate, 2-hydroxyethyl 2-hydroxybenzoate and methyl 2-hydroxybenzoateRefChem:131406DTXCID80161401SCHEMBL29349523
Database identifiers
- CAS
92172-29-7- PubChem CID
- 174850
- DTXSID
DTXSID30238910
Properties
Computed structural properties
- Topological polar surface area
- 199 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 11
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 594
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…