Basic information
- CAS
6314-12-1- Standard SMILES
Cc1nc(N)nc(Cl)c1Br- InChIKey
HSYWUFCGTXDANS-UHFFFAOYSA-N- Molecular formula
- C5H5BrClN3
- Average molar mass
- 222.47 g/mol
- Monoisotopic mass
- 220.93553694
Names & identifiers
- Preferred name
- 5-Bromo-4-chloro-6-methylpyrimidin-2-amine
- IUPAC
- 5-bromo-4-chloro-6-methylpyrimidin-2-amine
- English name
- 2-Pyrimidinamine, 5-bromo-4-chloro-6-methyl-
- Molecular formula
- C5H5BrClN3
- Molecular weight
- 222.47
Names & synonyms
5-bromo-4-chloro-6-methylpyrimidin-2-amine6314-12-1NSC-40200E6BZ3WQQ7GDTXSID90285001RefChem:1072732DTXCID70236152MFCD002754212-PYRIMIDINAMINE, 5-BROMO-4-CHLORO-6-METHYL-5-bromo-4-chloro-6-methyl-2-pyrimidinamine2-AMINO-5-BROMO-4-CHLORO-6-METHYLPYRIMIDINE5-bromo-4-chloro-6-methyl-pyrimidin-2-amine
Show more names
NSC 402002-PYRIMIDINAMINE, 5-BROMO-4-CHLORO-6-METHYL- ISO 9001：2015 REACH
NSC40200SCHEMBL1983684HSYWUFCGTXDANS-UHFFFAOYSA-NAKOS015833968DS-0763PB29065FB144130SY097051
Database identifiers
- CAS
6314-12-1- PubChem CID
- 237008
- DTXSID
DTXSID90285001- UNII
- E6BZ3WQQ7G
- EC Number
- 177-727-6
- Nikkaji
- J2.314.410G
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 123
Physicochemical properties
- Density
- 1.815 · 1.815
- storage temp.
- -20 °C, · -20°C, sealed storage, away from moisture and light
- Appearance
- Off-white to light brown Solid
- FDA UNII
- 6 BZ3WQQ7G · E6BZ3WQQ7G
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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 statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers43 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
Aladdin Scientific[email protected]
常州市捷诺医药科技有限公司13915093723
上海君悦生物科技有限公司021-51370612 · [email protected]
梯希爱（上海）化工贸易有限公司
Related reactions
6 records
Compound notes
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