Basic information
- CAS
7149-27-1- Standard SMILES
C=CC(C)(CCC=C(C)C)OC(=O)c1ccccc1NC- InChIKey
YSISVWIJMAXDQL-UHFFFAOYSA-N- Molecular formula
- C18H25NO2
- Average molar mass
- 287.4 g/mol
- Monoisotopic mass
- 287.18852904
Names & identifiers
- Preferred name
- 1,5-Dimethyl-1-vinyl-4-hexenyl 2-(methylamino)benzoate
- IUPAC
- 3,7-dimethylocta-1,6-dien-3-yl 2-(methylamino)benzoate
- English name
- 1,5-dimethyl-1-vinyl-4-hexenyl 2-(methylamino)benzoate
- Molecular formula
- C18H25NO2
- Molecular weight
- 287.3966
Names & synonyms
7149-27-11,5-Dimethyl-1-vinyl-4-hexenyl 2-(methylamino)benzoate3,7-dimethylocta-1,6-dien-3-yl 2-(methylamino)benzoateNSC72027EINECS 230-473-0SCHEMBL29483202YSISVWIJMAXDQL-UHFFFAOYSA-NDTXSID001187562NSC 72027NSC-72027NS000437761-Ethenyl-1,5-dimethyl-4-hexen-1-yl 2-(methylamino)benzoate
Show more names
2-(Methylamino)benzoic acid 1-ethenyl-1,5-dimethyl-4-hexenyl esterBenzoic acid, 2-(methylamino)-, 1-ethenyl-1,5-dimethyl-4-hexen-1-yl ester
Database identifiers
- CAS
7149-27-1- PubChem CID
- 98041
- DTXSID
DTXSID001187562- EC Number
- 230-473-0
- Nikkaji
- J227.403E
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 385
Chemistry & industry
Suppliers1 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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