Basic information
- CAS
214417-91-1- Standard SMILES
C/C(CC(C)C)=N/NC(=O)c1cc2ccccc2cc1O- InChIKey
HPTJCEPNQHYWIH-PDGQHHTCSA-N- Molecular formula
- C17H20N2O2
- Average molar mass
- 284.35 g/mol
- Monoisotopic mass
- 284.15247789
Names & identifiers
- Preferred name
- N'-(1,3-dimethylbutylidene)-3-hydroxy-2-naphthohydrazide
- IUPAC
- 3-hydroxy-N-[(Z)-4-methylpentan-2-ylideneamino]naphthalene-2-carboxamide
- English name
- N'-(1,3-dimethylbutylidene)-3-hydroxy-2-naphthohydrazide
- Molecular formula
- C17H20N2O2
- Molecular weight
- 284.35
Names & synonyms
N'-(1,3-Dimethylbutylidene)-3-hydroxy-2-naphthohydrazideEC 435-860-1214417-91-1DTXSID5010361583-hydroxy-N-((Z)-4-methylpentan-2-ylideneamino)naphthalene-2-carboxamide3-hydroxy-N-[(Z)-4-methylpentan-2-ylideneamino]naphthalene-2-carboxamideRefChem:819970DTXCID401520368435-860-1SCHEMBL1278351HPTJCEPNQHYWIH-PDGQHHTCSA-NN'-(1,3-dimethylbutene)-3-Hydroxy-2-naphthohydrazine
Show more names
3-Hydroxy-N'-(4-methylpentan-2-ylidene)-2-naphthohydrazide2-Naphthalenecarboxylic acid, 3-hydroxy-, 2-(1,3-dimethylbutylidene)hydrazide
Database identifiers
- CAS
214417-91-1- PubChem CID
- 5779530
- EC Number
- 435-860-1
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 392
Experimental & physicochemical properties
Physical DescriptionLarge Crystals
Physicochemical properties
- Density
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- vapor pressure
- 0.33 Pa · 0.33Pa at 20℃
- pka
- 8.82 · 8.82±0.40(Predicted)
- Water Solubility
- 4.37 mg/L · 4.37mg/L at 20℃
- LogP
- 1.7 at · 1.7 at 20℃
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 317 · H317-H411
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
- TSCA
- TSCA listed
- REACH Registrations
- Active
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
H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Warning
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information
2-Naphthalenecarboxylic acid, 3-hydroxy-, 2-(1,3-dimethylbutylidene)hydrazide is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Naphthalenecarboxylic acid, 3-hydroxy-, 2-(1,3-dimethylbutylidene)hydrazide are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: N'-(1,3-dimethylbutylidene)-3-hydroxy-2-naphthohydrazide (EC: 435-860-1)
Hazard Classes and Categories
Skin Sens. 1 (100%)
Skin sensitisation - category 1
Skin sensitization - Category 1A
Skin Sens. 1
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H317-H411
- REACH Registrations
- Active
- Precautionary statements
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 340,500 lb
Consumer UsesOther
Industry UsesIntermediate
General Manufacturing Information
Rubber Product Manufacturing
2-Naphthalenecarboxylic acid, 3-hydroxy-, 2-(1,3-dimethylbutylidene)hydrazide: ACTIVE
Suppliers32 total
湖北瑞凯兴科技股份有限公司0086-13795397680 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海合玖化学有限公司21-64171223 15216718324 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
南京道格生物医药科技有限公司025-58227606 18021503536 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
湖北长耀生物科技有限公司17683887209 17683887209 · [email protected]
武汉贝乐叶生物医药科技有限公司18086118076; 18086118070 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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