Basic information
- CAS
28735-29-7- Standard SMILES
NNc1nncc(-c2ccccc2)n1- InChIKey
XNMHGSWBLYFSHI-UHFFFAOYSA-N- Molecular formula
- C9H9N5
- Average molar mass
- 187.2 g/mol
- Monoisotopic mass
- 187.08579529
Names & identifiers
- Preferred name
- as-Triazine, 3-hydrazino-5-phenyl-
- IUPAC
- (5-phenyl-1,2,4-triazin-3-yl)hydrazine
- English name
- CHEMBRDG-BB 4015434
- Molecular formula
- C9H9N5
- Molecular weight
- 187.2
Names & synonyms
3-Hydrazino-5-phenyl-1,2,4-triazine28735-29-7as-Triazine, 3-hydrazino-5-phenyl-EHZ4RKE2MBNSC-146050DTXSID00182895RefChem:1077267DTXCID401053863-hydrazinyl-5-phenyl-1,2,4-triazineMFCD00460420(5-phenyl-1,2,4-triazin-3-yl)hydrazine1,2,4-Triazine, 3-hydrazinyl-5-phenyl-
Show more names
CHEMBRDG-BB 40154343-hydrazino-5-phenyl-1,2,4-triazine(SALTDATA: FREE)
3-Hydrazino-5-phenyl-as-triazineNSC 146050BRN 01593361,2,4-Triazin-3(2H)-one, 5-phenyl-, hydrazoneNSC146050BAS 00082731CHEMBL3247445SCHEMBL11126066
Database identifiers
- CAS
28735-29-7- PubChem CID
- 98542
- DTXSID
DTXSID00182895- ChEMBL
CHEMBL3247445- UNII
- EHZ4RKE2MB
- Nikkaji
- J92.273K
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Melting point
- 148 · 148-149 °C(Solv: methanol (67-56-1))
- Boiling point
- 336.9 · 336.9±25.0 °C(Predicted)
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- pka
- 5.35 · 5.35±0.20(Predicted)
Chemistry & industry
Suppliers1 total
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
1 records
Compound notes
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