Basic information
- CAS
42438-10-8- Standard SMILES
CCCCCOc1ccc(NC(=O)OC(C)C[NH+]2CCCC2)cc1.[Cl-]- InChIKey
XCDWXBPESJIOJK-UHFFFAOYSA-N- Molecular formula
- C19H31ClN2O3
- Average molar mass
- 370.9 g/mol
- Monoisotopic mass
- 370.2023205
Names & identifiers
- Preferred name
- Carbamic acid, (4-(pentyloxy)phenyl)-, 1-methyl-2-(1-pyrrolidinyl)ethyl ester, monohydrochloride
- IUPAC
- 1-pyrrolidin-1-ium-1-ylpropan-2-yl N-(4-pentoxyphenyl)carbamate chloride
Names & synonyms
(4-(Pentyloxy)phenyl)carbamic acid 1-methyl-2-(1-pyrrolidinyl)ethyl ester hydrochlorideCarbamic acid, (4-(pentyloxy)phenyl)-, 1-methyl-2-(1-pyrrolidinyl)ethyl ester, monohydrochlorideCarbanilic acid, p-pentyloxy-, 1-methyl-2-(1-pyrrolidinyl)ethyl ester, hydrochloride42438-10-8RefChem:332107
Database identifiers
- CAS
42438-10-8- PubChem CID
- 39203
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 351
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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