Basic information
- CAS
1917-97-1- Standard SMILES
CCCCCCC(C)OC(=O)COc1ccc(Cl)cc1Cl- InChIKey
GJNVTNDAZUATRV-UHFFFAOYSA-N- Molecular formula
- C16H22Cl2O3
- Average molar mass
- 333.2 g/mol
- Monoisotopic mass
- 332.0945999
Overview
2-(2,4-dichlorophenoxy)acetic acid octan-2-yl ester is a monocarboxylic acid.
Names & identifiers
- Preferred name
- 2,4-D-meptyl
- IUPAC
- octan-2-yl 2-(2,4-dichlorophenoxy)acetate
- English name
- octan-2-yl 2-(2,4-dichlorophenoxy)acetate
- Molecular formula
- C16H22Cl2O3
- Molecular weight
- 333.25
Names & synonyms
1917-97-12,4-D-meptylCaswell No. 315AU2,4-D-meptyl [ISO]2,4-D 2-octyl esterAcetic acid, 2-(2,4-dichlorophenoxy)-, 1-methylheptyl ester2,4-D, 2-octyl ester2-Octanol, (2,4-dichlorophenoxy)acetate6P9YR9Z214EPA Pesticide Chemical Code 030065BRN 22932192,4-D MEPTYL ESTER
Show more names
2,4-D IOE2,4-D Octan-2-yl Ester2-Octyl 2,4-dichlorophenoxyacetate
UNII-6P9YR9Z214Acetic acid, (2,4-dichlorophenoxy)-, 1-methylheptyl esterDTXSID6041343RefChem:82230DTXCID4021343octan-2-yl 2-(2,4-dichlorophenoxy)acetateOctan-2-yl (2,4-Dichlorophenoxy)acetateMFCD01671994
Database identifiers
- CAS
1917-97-1- PubChem CID
- 1487
- DTXSID
DTXSID6041343- ChEMBL
CHEMBL1314736- ChEBI
CHEBI:110166- UNII
- 6P9YR9Z214
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 299
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Boiling point
- 449.37 °C · 449.37°C (rough estimate)
- Density
- 1.1506 · 1.1506 (rough estimate)
- refractive index
- 1.581 · 1.5810 (estimate)
- form
- clear liquid
- color
- Colorless to Light orange to Yellow
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 6 P9YR9Z214 · 6P9YR9Z214
- EPA Substance Registry System
- 2 · 2,4-D 2-octyl ester (1917-97-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2918.99.4700
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Suppliers21 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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