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2,3-Dimethylpyrido[2,3-b]pyrazine

HCID 252159
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Basic information

CAS
7154-32-7
Standard SMILES
Cc1nc2cccnc2nc1C
InChIKey
TYSBLMVKFMRPQF-UHFFFAOYSA-N
Molecular formula
C9H9N3
Average molar mass
159.19 g/mol
Monoisotopic mass
159.0796473

Names & identifiers

Preferred name
2,3-Dimethylpyrido[2,3-b]pyrazine
IUPAC
2,3-dimethylpyrido[2,3-b]pyrazine
English name
2,3-DIMETHYLPYRIDO[2,3-B]PYRAZINE
Molecular formula
C9H9N3
Molecular weight
159.19

Names & synonyms

2,3-dimethylpyrido[2,3-b]pyrazine7154-32-7MFCD03012163MLS0007368082,3-dimethylpyrido(2,3-b)pyrazineNSC73507A1AYTSCHEMBL1616244CHEMBL1892443DTXSID70291145HMS2885E05NSC 73507
Show more names
SALOR-INT L131792-1EAPyrido[2,3-b]pyrazine, 2,3-dimethyl-
NSC-735072,3-dimethylpyridino[2,3-b]pyrazineAKOS003390004SMR000528332ST45022535ST505121563T-0629

Database identifiers

CAS
7154-32-7
PubChem CID
252159
DTXSID
DTXSID70291145
ChEMBL
CHEMBL1892443
EC Number
121-787-8
Nikkaji
J2.816.921C

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
38.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Formal charge
0
Complexity
160

Physicochemical properties

Melting point
143 · 143-144 °C
Boiling point
268.3 · 268.3±35.0 °C(Predicted)
Density
1.172 · 1.172±0.06 g/cm3(Predicted)
pka
1.97 · 1.97±0.30(Predicted)

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 · 4 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (100%)

Related reactions

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Compound notes

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