Basic information
- CAS
3086-72-4- Standard SMILES
COc1cc(C(N)=O)cc(OC)c1O- InChIKey
XWMSEZHMHBQVLE-UHFFFAOYSA-N- Molecular formula
- C9H11NO4
- Average molar mass
- 197.19 g/mol
- Monoisotopic mass
- 197.06880783
Names & identifiers
- Preferred name
- 4-Hydroxy-3,5-dimethoxybenzamide
- IUPAC
- 4-hydroxy-3,5-dimethoxybenzamide
- English name
- 3,5-Dimethoxy-4-hydroxybenzamide
- Molecular formula
- C9H11NO4
- Molecular weight
- 197.19
Names & synonyms
4-Hydroxy-3,5-dimethoxybenzamide3086-72-4syringamideBenzamide, 4-hydroxy-3,5-dimethoxy-L8Y9YLN9U9NSC-164893DTXSID3074573NSC 164893RefChem:198690DTXCID80382733,5-Dimethoxy-4-hydroxybenzamideEINECS 221-407-1
Show more names
SYRINGIC AMIDEEsomeprazole Sodium /Potassium3,5-dimethoxy-4-hydroxy-benzamid
Benzamide, 3,5-dimethoxy-4-hydroxy-BRN 2649582NSC164893UNII-L8Y9YLN9U9SCHEMBL502534orb3171089XWMSEZHMHBQVLE-UHFFFAOYSA-NAKOS006281043
Database identifiers
- CAS
3086-72-4- PubChem CID
- 76522
- DTXSID
DTXSID3074573- UNII
- L8Y9YLN9U9
- EC Number
- 221-407-1
- Nikkaji
- J217.251H
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 195
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 184 · 184-185 °C(Solv: water (7732-18-5))
- Boiling point
- 302.7 · 302.7±42.0 °C(Predicted)
- Density
- 1.275 · 1.275±0.06 g/cm3(Predicted)
- pka
- 8.67 · 8.67±0.23(Predicted)
- FDA UNII
- 8 Y9YLN9U9 · L8Y9YLN9U9
- EPA Substance Registry System
- 4 · Benzamide, 4-hydroxy-3,5-dimethoxy- (3086-72-4)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
- TSCA
- TSCA listed
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
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P203, P264+P265, P280, P305+P351+P338, P318, P337+P317, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzamide, 4-hydroxy-3,5-dimethoxy-: ACTIVE
Suppliers25 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
深圳康特腾科技有限公司86-0755-86635001 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
嘉兴市德亿化工有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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