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Basic information
- CAS
77817-12-0- Standard SMILES
COC(=O)c1cc(N)ncn1- InChIKey
URSUGGQRGURMAM-UHFFFAOYSA-N- Molecular formula
- C6H7N3O2
- Average molar mass
- 153.14 g/mol
- Monoisotopic mass
- 153.05382648
Names & identifiers
- Preferred name
- Methyl 6-aminopyrimidine-4-carboxylate
- IUPAC
- methyl 6-aminopyrimidine-4-carboxylate
- English name
- 4-Pyrimidinecarboxylicacid,6-amino-,methylester(9CI)
- Molecular formula
- C6H7N3O2
- Molecular weight
- 153.14
Names & synonyms
Methyl 6-aminopyrimidine-4-carboxylate77817-12-0DTXSID40620741RefChem:356259DTXCID30571495MFCD13174840Methyl-6-aminopyrimidine-4-carboxylateMethyl6-aminopyrimidine-4-carboxylateSCHEMBL7925114-pyrimidinecarboxylic acid,6-amino-,methyl esterURSUGGQRGURMAM-UHFFFAOYSA-NAKOS016005955
Show more names
4-amino-6-methoxycarbonylpyrimidineMethyl6-amipyrimidine-4-carboxylate4-Pyrimidinecarboxylic acid, 6-amino-, methyl ester4-Pyrimidinecarboxylicacid,6-amino-,methylester(9CI)
SB55646AS-34984SY097870DB-431570CS-0048951EN300-2024726-Amino-4-Pyrimidinecarboxylic Acid Methyl esterF230648
Database identifiers
- CAS
77817-12-0- PubChem CID
- 21955432
- DTXSID
DTXSID40620741- EC Number
- 880-031-1
Properties
Computed structural propertiesFilling in
- XLogP
- 0
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- storage temp.
- 0 · Store at 0-8 °C
- Appearance
- yellow solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- HS Code
- 2933599590 · 2933599590
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]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- hs_code
- 2933599590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Applications
Uses6-Aminopyrimidine-4-carboxylic acid methyl ester can be used as a synthetic intermediate in pharmaceuticals and chemicals. If inhaled, the patient should be moved to fresh air; if skin contact occurs, contaminated clothing should be removed, and the skin thoroughly washed with soap and water. If discomfort persists, seek medical attention.
Suppliers28 total
韶远科技(上海)有限公司4000665055 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
河南多贝化工有限公司0370-6999054 17550096163 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Aladdin Scientific[email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]
上海舒盟医药科技有限公司021-54540637 18621091017 · [email protected]
河南多贝化工有限公司0370-2785118 17550508557 · [email protected]
Related reactions
2 records
Compound notes
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