Basic information
- CAS
59643-84-4- Standard SMILES
CCCOc1ccccc1C(N)=O- InChIKey
FAVIQMSTEFBUJX-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
- Monoisotopic mass
- 179.09462866
Names & identifiers
- Preferred name
- 2-Propoxybenzamide
- IUPAC
- 2-propoxybenzamide
- English name
- o-propoxybenzamide
- Molecular formula
- C10H13NO2
- Molecular weight
- 179.22
Names & synonyms
2-propoxybenzamide59643-84-4BENZAMIDE, o-PROPOXY-HTN6B4G58BDTXSID30208310RefChem:1064581DTXCID50130801261-836-1o-Propoxybenzamide2-n-PropoxybenzamideBenzamide, 2-propoxy-H.P. 206
Show more names
HLP-206Reuprosalo-PropoxybenazaMide
Propenzamide; Reuprosal; o-Propoxybenazamide;EINECS 261-836-1BRN 29660432-propoxy-benzamideSCHEMBL73449SCHEMBL3352936SCHEMBL6709213MFCD00031465
Database identifiers
- CAS
59643-84-4- PubChem CID
- 43051
- DTXSID
DTXSID30208310- UNII
- HTN6B4G58B
- EC Number
- 261-836-1
- Nikkaji
- J149.177F
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Physicochemical properties
- Melting point
- 94 · 94-96°C
- Boiling point
- 311.75 °C · 311.75°C (rough estimate)
- Density
- 1.1248 · 1.1248 (rough estimate)
- refractive index
- 1.515 · 1.5150 (estimate)
- pka
- 15.61 · 15.61±0.50(Predicted)
- form
- White Crystalline Needles
Safety & regulation
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (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
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Chemistry & industry
Applications
Uses2-Propoxybenzamide (cas# 59643-84-4) is a compound useful in organic synthesis.
Suppliers11 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [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]
凯试（上海）科技有限公司021-50135380 · [email protected]
大连金点生物科技有限公司0411-0411-00000000 13644282108 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海梦蓝医药科技有限公司13062660007 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
13 records
Compound notes
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