(2,3-dimethylphenyl)hydrazine hydrochloride

• ChemBase ID: 90144
• Molecular Formular: C8H13ClN2
• Molecular Mass: 172.65522
• Monoisotopic Mass: 172.07672611
• SMILES: N(c1c(c(ccc1)C)C)N.Cl
• Canonical SMILES: NNc1cccc(c1C)C.Cl
• InChI: InChI=1S/C8H12N2.ClH/c1-6-4-3-5-8(10-9)7(6)2;/h3-5,10H,9H2,1-2H3;1H
• InChIKey: UKAYNIJBIXNDDJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2,3-dimethylphenyl)hydrazine hydrochloride
• IUPAC Traditional name: (2,3-dimethylphenyl)hydrazine hydrochloride
• Synonyms: 2,3-Dimethylphenylhydrazine hydrochloride; 3-Hydrazino-o-xylene hydrochloride; 2,3-Dimethylphenylhydrazine hydrochloride 97%; 2,3-二甲基苯基肼 盐酸盐

Database IDs

• CAS Number: 56737-75-8
• MDL Number: MFCD00013380
• Beilstein Number: 6096287
• PubChem SID: 162076999
• PubChem CID: 2774885

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 2.136637
• LogD (pH = 7.4): 2.3873806
• Log P: 2.3917313
• Molar Refractivity: 45.8471 cm^3
• Polarizability: 16.438433 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 210(dec.)°C; ca 210°C dec.

Safety Information

• Storage Warning: Harmful/Irritant/Store under Argon
• RTECS: MV3262500
• European Hazard Symbols: X
• Risk Statements: 22
• Safety Statements: 36
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H302-H313
• GHS Precautionary statements: P264-P270-P301+P312-P312-P330-P501A

Product Information

• Purity: 97%