3-Methylbutyl (4-aminophenyl)acetate--hydrogen chloride (1/1)
Basic information
- CAS
73623-41-3- Standard SMILES
CC(C)CCOC(=O)Cc1ccc([NH3+])cc1.[Cl-]- InChIKey
HGHZILICJBJIQU-UHFFFAOYSA-N- Molecular formula
- C13H20ClNO2
- Average molar mass
- 257.75 g/mol
- Monoisotopic mass
- 257.1182566
Names & identifiers
- Preferred name
- 3-Methylbutyl (4-aminophenyl)acetate--hydrogen chloride (1/1)
- IUPAC
- [4-[2-(3-methylbutoxy)-2-oxoethyl]phenyl]azanium chloride
Names & synonyms
73623-41-3DTXSID709944273-Methylbutyl (4-aminophenyl)acetate--hydrogen chloride (1/1)RefChem:1068287DTXCID901421462(p-Aminophenyl)acetic acid isopentyl ester hydrochloridep-Amino-phenylessigsaeureisoamylester hydrochlorid [German]ACETIC ACID, (p-AMINOPHENYL)-, ISOPENTYL ESTER, HYDROCHLORIDEp-Amino-phenylessigsaeureisoamylester hydrochlorid
Database identifiers
- CAS
73623-41-3- PubChem CID
- 51928
Properties
Computed structural properties
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 208
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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