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5-Methyl-3-oxo-2,3-dihydropyridazine-4-carboxylic acid

HCID 12376260
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
342402-51-1
Standard SMILES
Cc1cn[nH]c(=O)c1C(=O)O
InChIKey
RIYUOHRYWJPQBP-UHFFFAOYSA-N
Molecular formula
C6H6N2O3
Average molar mass
154.12 g/mol
Monoisotopic mass
154.03784206

Names & identifiers

Preferred name
5-Methyl-3-oxo-2,3-dihydropyridazine-4-carboxylic acid
IUPAC
4-methyl-6-oxo-1H-pyridazine-5-carboxylic acid
English name
4-Pyridazinecarboxylicacid,2,3-dihydro-5-methyl-3-oxo-(9CI)
Molecular formula
C6H6N2O3
Molecular weight
154.12

Names & synonyms

342402-51-15-Methyl-3-oxo-2,3-dihydropyridazine-4-carboxylic acidDTXSID00495119RefChem:304134DTXCID70445929867-247-12,3-Dihydro-5-methyl-3-oxopyridazine-4-carboxylic acid4-methyl-6-oxo-1H-pyridazine-5-carboxylic acidMFCD11035719SCHEMBL28299221SNA40251DB-283894
Show more names
4-Pyridazinecarboxylicacid,2,3-dihydro-5-methyl-3-oxo-(9CI)
EN300-42553165-Methyl-3-oxo-2,3-dihydropyridazine-4-carboxylicacidZ27333174014-PYRIDAZINECARBOXYLIC ACID, 2,3-DIHYDRO-5-METHYL-3-OXO-

Database identifiers

CAS
342402-51-1
PubChem CID
12376260
DTXSID
DTXSID00495119
EC Number
867-247-1

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
78.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
278

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H315-H335-H302
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Hazard Codes
Xi
HS Code
2933998090 · 2933998090

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

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, 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. 4 (100%)

Safety data

hs_code
2933998090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
Hazard statements
H319-H315-H335-H302
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501

Chemistry & industry

Upstream & downstream products

Downstream products

3-Chloro-5-methylpyridazine

Suppliers1 total

上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Related reactions

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Compound notes

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