Basic information
- CAS
29104-30-1- Standard SMILES
CCN(OC(=O)c1ccccc1)C(=O)c1c(OC)ccc(Cl)c1OC- InChIKey
HOERQTQCTISLFR-UHFFFAOYSA-N- Molecular formula
- C18H18ClNO5
- Average molar mass
- 363.8 g/mol
- Monoisotopic mass
- 363.08735036
Names & identifiers
- Preferred name
- Benzoximate
- IUPAC
- [(3-chloro-2,6-dimethoxybenzoyl)-ethylamino] benzoate
- English name
- Benzoximate
- Molecular formula
- C18H18ClNO5
- Molecular weight
- 363.79
Names & synonyms
BenzoxamateAzomateAcarmateArtabanBenzoximate [BSI:ISO]NA-53MNA-53EINECS 249-439-1BRN 278331932TAI9ZK5NBenzoic acid anhydride with 3-chloro-N-ethoxy-2,6-dimethoxybenzenecarboximidic acidRefChem:566441
Show more names
NA 53MCITRAZONAazomateCitrastarBENZOMATEBENZOXIMATE
DTXCID20810108Benzoic acid anhydride with 3-chloro-N-ethoxy-2,6-dimethoxybenzenecarboximidic acid (9CI)249-439-129104-30-13-chloro-alpha-ethoxyimino-2,6-dimethoxybenzyl benzoateBenzoic 3-chloro-N-ethoxy-2,6-dimethoxybenzimidic anhydrideBenzoic acid, anhydride with 3-chloro-N-ethoxy-2,6-dimethoxybenzenecarboximidic acidBenzoic acid, anhydride with 3-chloro-N-ethoxy-2,6-dimethoxybenzimidic acid
Database identifiers
- CAS
29104-30-1、67011-39-6- PubChem CID
- 34475
- DTXSID
DTXSID001325320- EC Number
- 249-439-1
- Nikkaji
- J108.072E
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 455
Experimental & physicochemical properties
Pesticides
Acaricides
Active substance -> EU Pesticides database: Not approved
LogP3.73
Physicochemical properties
- Melting point
- 73 ℃ · 73℃
- Boiling point
- 483.3 · 483.3±55.0 °C(Predicted)
- Density
- 1.21 · 1.21
- storage temp.
- 0 · 0-6°C
- solubility
- DMSO (Slightly), Methanol, (Slightly)
- form
- Solid
- color
- White to Off-White
- Water Solubility
- 30.26 mg/L · 30.26mg/L(temperature not stated)
- Henry's Law Constant
- 1.8 · 1.8×102 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
- CAS DataBase Reference
- 29104 · 29104-30-1
- FDA UNII
- 32 TAI9ZK5N · 32TAI9ZK5N
Safety & regulation
GHS classification
GHS Classification
H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory Information2002/2076
Hazard Classes and CategoriesAquatic Chronic 3 (100%)
Safety data
- rtecs
- DF9700000
- hs_code
- 29280000
- Hazard statements
- H412
- Precautionary statements
- P273-P501
Chemistry & industry
Applications
DescriptionBenzoximate is an acaricide used to control all stages of spider mites on pome fruit, stone fruit, citrus fruit, vines and ornamentals. It was commercialized in Japan in 1971 but discontinued there in 1998 and is currently registered only in Italy, South Korea, South Africa and Switzerland.
UsesBenzoximate is an acaricide that inhibits fruit tree red spider mite Panonychys ulmi (Koch)[1].
Upstream & downstream products
Upstream raw materials
Suppliers40 total
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [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]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海毕楷科技有限公司18516304666
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
Related reactions
1 records
Compound notes
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