6-Chloro-5-methylpyridin-3-amine

HCID 12295607

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Basic information

CAS: 38186-82-2
Standard SMILES: Cc1cc(N)cnc1Cl
InChIKey: VSBISZPNLZFTPG-UHFFFAOYSA-N
Molecular formula: C6H7ClN2
Average molar mass: 142.58 g/mol
Monoisotopic mass: 142.0297759

Names & identifiers

Preferred name: 6-Chloro-5-methylpyridin-3-amine
IUPAC: 6-chloro-5-methylpyridin-3-amine
English name: 5-Amino-2-chloro-3-picoline
Molecular formula: C6H7ClN2
Molecular weight: 142.59

Names & synonyms

6-Chloro-5-methylpyridin-3-amine38186-82-25-Amino-2-chloro-3-picoline5-Amino-2-chloro-3-methylpyridine2-Chloro-3-methyl-5-aminopyridineMFCD030950873-Pyridinamine, 6-chloro-5-methyl-6-Chloro-5-methyl-pyridin-3-ylamineSCHEMBL1156177SCHEMBL30135192DTXSID10485485VSBISZPNLZFTPG-UHFFFAOYSA-N

Show more names

5-Aminoro-3-picoL2-CHLORO-5-AMINO-3-PICOLINE5-Amino-2-chloro-3-picoline ,97%6-Chloro-5-methyl-3-pyridinamine3-amine-6-chloro-5-methylpyridine

6-chloro-5-methyl-3-pyridylamine6-chloro-5-methyl-pyridin-3-amineSBB051914AKOS005258273AB13470PS-5094SB18614AC-23036

Database identifiers

CAS: 38186-82-2
PubChem CID: 12295607
DTXSID: DTXSID10485485
EC Number: 640-538-9
Nikkaji: J3.628.537K

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 38.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 97

Physicochemical properties

Melting point: 90 to · 90.0 to 94.0 °C
Boiling point: 304.7 · 304.7±37.0 °C(Predicted)
Density: 1.26 · 1.260±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
form: powder to crystalline
pka: 2.06 · 2.06±0.10(Predicted)
color: White to Brown
InChI: InChI=1S/C6H7ClN2/c1-4-2-5(8)3-9-6(4)7/h2-3H,8H2,1H3
InChIKey: VSBISZPNLZFTPG-UHFFFAOYSA-N
SMILES: C1=NC(Cl)=C(C)C=C1N
CAS DataBase Reference: 38186 · 38186-82-2(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302-H315-H318-H335
Precautionary statements: 280 · P280-P301+P312+P330-P302+P352-P305+P351+P338+P310
target organs: Respiratory system
Hazard Codes: Xn
Risk Statements: 22 · 22-37/38-41-36/37/38-20/21/22
Safety Statements: 26 · 26-39-36/37/39
RIDADR: 2811 · 2811
WGK Germany: 3 · 3
HS Code: 29333990 · 29333990
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 4 OralEye · Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3