Basic information
- Standard SMILES
COC(=O)c1ccc(N)c(OC(C)C)c1- InChIKey
AQIZZMSROAYWPJ-UHFFFAOYSA-N- Molecular formula
- C11H15NO3
- Average molar mass
- 209.24 g/mol
- Monoisotopic mass
- 209.10519334
Names & identifiers
- Preferred name
- Methyl 4-amino-3-isopropoxybenzoate
- IUPAC
- methyl 4-amino-3-propan-2-yloxybenzoate
Names & synonyms
Methyl 4-amino-3-isopropoxybenzoate681465-85-0MFCD12168764methyl 4-amino-3-propan-2-yloxybenzoateBenzoic acid, 4-amino-3-(1-methylethoxy)-, methyl ester (9CI)SCHEMBL3544032Benzoic acid, 4-amino-3-(1-methylethoxy)-, methyl esterAQIZZMSROAYWPJ-UHFFFAOYSA-NMethyl4-amino-3-isopropoxybenzoatemethyl 4-amino-3-isopropoxy-benzoateAKOS009475848SB78587
Show more names
Methyl4-amino-3-propan-2-yloxy-benzoateDS-18826SY290064Methyl 4-amino-3-isopropoxybenzoate, 97%DB-298000CS-01609044-Amino-3-isopropoxy-benzoic acid methyl esterC76159
Database identifiers
- PubChem CID
- 43380211
- Nikkaji
- J2.599.316K
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Related reactions
2 records
Compound notes
Loading…