Basic information
- CAS
119-29-9- Standard SMILES
CCCCOc1cc(N)ccc1C(=O)OCCN(CC)CC- InChIKey
ZLMQPGUWYWFPEG-UHFFFAOYSA-N- Molecular formula
- C17H28N2O3
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.20999276
Names & identifiers
- Preferred name
- Ambucaine
- IUPAC
- 2-(diethylamino)ethyl 4-amino-2-butoxybenzoate
- English name
- Ambucaine
- Molecular formula
- C17H28N2O3
- Molecular weight
- 308.419
Names & synonyms
AmbucaineAmbutoxateAmbucainSympocain2-(Diethylamino)ethyl 4-amino-2-butoxybenzoateAmbucaina119-29-9Ambucaine [INN:DCF]AmbucainumAmbucainum [INN-Latin]Ambucaina [INN-Spanish]UNII-M7G4B57ZCB
Show more names
S-813WIN-37062-diethylaminoethyl 4-azanyl-2-butoxy-benzoate4-amino-2-butoxy-benzoic acid 2-diethylaminoethyl ester
WIN 37062-Diethylaminoethyl 4-amino-2-butoxybenzoateM7G4B57ZCBBRN 2133720AMBUCAINE [INN]S 8132-Butoxy-4-aminobenzoic acid beta-diethylaminoethyl esterAMBUCAINE [MI]
Database identifiers
- CAS
119-29-9- PubChem CID
- 8387
- DTXSID
DTXSID50152280- ChEMBL
CHEMBL2104088- UNII
- M7G4B57ZCB
- Nikkaji
- J76.315B
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 64.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 308
Physicochemical properties
- FDA UNII
- 7 G4B57ZCB · M7G4B57ZCB
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers2 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
Shanghai New Union Textra Import & Export Co., Ltd.[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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