Basic information
- CAS
18189-07-6- Standard SMILES
CCCCCCCCCCOC(=O)c1ccccc1N- InChIKey
NMXZJPNAJUDMAC-UHFFFAOYSA-N- Molecular formula
- C17H27NO2
- Average molar mass
- 277.4 g/mol
- Monoisotopic mass
- 277.2041791
Names & identifiers
- Preferred name
- Benzoic acid, 2-amino-, decyl ester
- IUPAC
- decyl 2-aminobenzoate
- English name
- DECYL ANTHRANILATE
- Molecular formula
- C17H27NO2
- Molecular weight
- 277.4
Names & synonyms
Decyl anthranilateDecyl 2-aminobenzoate18189-07-6Benzoic acid, 2-amino-, decyl esterB99YZ6BC3MEINECS 242-077-5DTXSID9066336RefChem:565491DTXCID6035784242-077-52-aminobenzoic acid decyl esterDecyl 2-aminobenzoate #
Show more names
2-amino-benzoicacidecylesterBenzoicacid,2-amino-,decylester2-AMino-benzoicacidecylester,Decyl anthranilate
UNII-B99YZ6BC3MSCHEMBL873445AKOS012757943NS00012202D85944
Database identifiers
- CAS
18189-07-6- PubChem CID
- 87501
- DTXSID
DTXSID9066336- UNII
- B99YZ6BC3M
- EC Number
- 242-077-5
- Nikkaji
- J167.702K
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 255
Physicochemical properties
- Boiling point
- 388.2 · 388.2±15.0 °C(Predicted)
- Density
- 0.997 · 0.997
- refractive index
- 1.507 · 1.5070
- pka
- 2.17 · 2.17±0.10(Predicted)
- Odor
- 100 % · at 100.00 %. floral grape neroli
- Odor Type
- floral
- Cosmetics Ingredients Functions
- PERFUMING
- LogP
- 6.764 · 6.764 (est)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 99 YZ6BC3M · B99YZ6BC3M
- EPA Substance Registry System
- 2 · Benzoic acid, 2-amino-, decyl ester (18189-07-6)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H413
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 16.6% (89 of 535) of reports.
Warning
H315 (83.4%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 535 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Benzoic acid, 2-amino-, decyl ester
Benzoic acid, 2-amino-, decyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Benzoic acid, 2-amino-, decyl ester: Human health tier I assessment
Hazard Classes and CategoriesSkin Irrit. 2 (83.4%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H413
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzoic acid, 2-amino-, decyl ester: ACTIVE
Suppliers22 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
安徽省大利生物科技有限责任公司15705632007 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海纳谦化学科技有限公司13598610367 13598610367 · [email protected]
上海炎泽化工有限公司15345144255 19901447308 · [email protected]
山东英朗化工有限公司18266343295 · [email protected]
湖北中隆康盛精细化工有限公司027-83850381 18171045381 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
Zjartspharm Co., Ltd
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…