Methyl 2-amino-4-methylpyrimidine-5-carboxylate
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Basic information
- CAS
1023811-97-3- Standard SMILES
COC(=O)c1cnc(N)nc1C- InChIKey
TXAIGQFUQLUQJJ-UHFFFAOYSA-N- Molecular formula
- C7H9N3O2
- Average molar mass
- 167.17 g/mol
- Monoisotopic mass
- 167.06947654
Names & identifiers
- Preferred name
- Methyl 2-amino-4-methylpyrimidine-5-carboxylate
- IUPAC
- methyl 2-amino-4-methylpyrimidine-5-carboxylate
- English name
- methyl 2-amino-4-methyl-5-pyrimidinecarboxylate(SALTDATA: FREE)
- Molecular formula
- C7H9N3O2
- Molecular weight
- 167.17
Names & synonyms
methyl 2-amino-4-methylpyrimidine-5-carboxylate1023811-97-3DTXSID70652838RefChem:354049DTXCID30603588862-033-4METHYL 2-AMINO-4-METHYL-5-PYRIMIDINECARBOXYLATEMFCD098809295-pyrimidinecarboxylic acid, 2-amino-4-methyl-, methyl estermethyl2-amino-4-methylpyrimidine-5-carboxylateALBB-014076AKOS005174464
Show more names
methyl 2-amino-4-methyl-5-pyrimidinecarboxylate(SALTDATAmethyl 2-amino-4-methyl-5-pyrimidinecarboxylate(SALTDATA: FREE)
SB55759LS-04419CS-0309218G30891EN300-1698741methyl 2-amino-4-methyl-pyrimidine-5-carboxylateZ1198236094
Database identifiers
- CAS
1023811-97-3- PubChem CID
- 33702269
- DTXSID
DTXSID70652838- EC Number
- 862-033-4
- Nikkaji
- J2.851.683E
Properties
Computed structural propertiesFilling in
- XLogP
- 0.1
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
- HazardClass
- IRRITANT
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
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H319-H335-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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