Basic information
- CAS
100377-63-7- Standard SMILES
COc1cc(C(=O)NN)ccc1O- InChIKey
AWVJTGNFMZKXDN-UHFFFAOYSA-N- Molecular formula
- C8H10N2O3
- Average molar mass
- 182.18 g/mol
- Monoisotopic mass
- 182.06914219
Names & identifiers
- Preferred name
- 4-Hydroxy-3-methoxybenzohydrazide
- IUPAC
- 4-hydroxy-3-methoxybenzohydrazide
- English name
- Vanillic acid hydrazide
- Molecular formula
- C8H10N2O3
- Molecular weight
- 182.18
Names & synonyms
4-hydroxy-3-methoxybenzohydrazide100377-63-7DTXSID80332831RefChem:523827DTXCID70283924680-956-9Vanillic Acid HydrazideMFCD000170764-Hydroxy-3-methoxybenzhydrazideOprea1_419318Oprea1_6616764-Hydroxy-3-methoxy-benzoic acid hydrazide
Show more names
ST5054740AIDS-058511ZINC00405104VANILLIC ACID HYDRAZIDE, 98+%4-hydroxy-3-methoxybenzoic hydrazide
Benzoic acid, 4-hydroxy-3-methoxy-, hydrazide4-hydroxy-3-methoxy-benzohydrazideAIDS058511VanillinsaurehydrazonVanilic acid hydrazide4-???-2-methoxyphenolCHEMBL125640SCHEMBL2664428
Database identifiers
- CAS
100377-63-7- PubChem CID
- 468601
- DTXSID
DTXSID80332831- ChEMBL
CHEMBL125640- EC Number
- 680-956-9
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 84.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Melting point
- 213 · 213-216°C
- Density
- 1.307 · 1.307±0.06 g/cm3(Predicted)
- pka
- 8.61 · 8.61±0.20(Predicted)
- BRN
- 3268276 · 3268276
- Symbol(GHS)
- 7 · GHS07
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- HazardClass
- IRRITANT
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
Danger
H301 (16.7%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (16.7%)
Safety data
- risk_code
- 36/37/38
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers26 total
常州帝通化工有限公司+86-0519-88298848 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
Jinan Liheng Biotechnology Co., Ltd.15865262812 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
成都瑞欧克科技有限公司028-64353063 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
山东西亚化学有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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