Basic information
- CAS
52479-65-9- Standard SMILES
CNc1ccccc1C(=O)NN- InChIKey
QODRFAYDFCMGQK-UHFFFAOYSA-N- Molecular formula
- C8H11N3O
- Average molar mass
- 165.19 g/mol
- Monoisotopic mass
- 165.09021198
Overview
See also: 2-(Methylamino)benzoic acid hydrazide (annotation moved to).
Names & identifiers
- Preferred name
- Benzoic acid, 2-(methylamino)-, hydrazide
- IUPAC
- 2-(methylamino)benzohydrazide
- English name
- 2-(Methylamino)benzene-1-carbohydrazide
- Molecular formula
- C8H11N3O
- Molecular weight
- 165.19
Names & synonyms
Benzoic acid, 2-(methylamino)-, hydrazideRefChem:565458Benzoic acid, 2-(methylamino)-, hydrazide (9CI)2-(methylamino)benzohydrazide52479-65-9Anthranilic acid, N-methyl-, hydrazide2-(methylamino)benzene-1-carbohydrazideN-Methylanthranilic acid hydrazideNSC 106928BRN 2936489Maybridge1_0034084-14-00-01017 (Beilstein Handbook Reference)
Show more names
n-methyl-anthranilicacihydrazide
SCHEMBL960781HMS551C20DTXSID20200464CCA47965CCG-54738NSC106928AKOS002666258NSC-106928
Database identifiers
- CAS
52479-65-9- PubChem CID
- 98337
- DTXSID
DTXSID20200464- Nikkaji
- J30.700I
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 146 · 146-147 °C
- Boiling point
- 293.03 °C · 293.03°C (rough estimate)
- Density
- 1.1669 · 1.1669 (rough estimate)
- refractive index
- 1.74 · 1.7400 (estimate)
- pka
- 12.9 · 12.90±0.10(Predicted)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 317 · H317-H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H317-H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Chemistry & industry
Suppliers4 total
Ryan Scientific, Inc.[email protected]
深圳爱拓化学有限公司0755- 33239182 · [email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Service Chemical Inc.[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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