Basic information
- CAS
35265-83-9- Standard SMILES
Cc1csc2c(Cl)nc(Cl)nc12- InChIKey
WUXYWALKGQDXFI-UHFFFAOYSA-N- Molecular formula
- C7H4Cl2N2S
- Average molar mass
- 219.09 g/mol
- Monoisotopic mass
- 217.94722449
Names & identifiers
- Preferred name
- 2,4-Dichloro-7-methylthieno(3,2-d)pyrimidine
- IUPAC
- 2,4-dichloro-7-methylthieno[3,2-d]pyrimidine
- English name
- 2,4-Dichloro-7-methylthieno[3,2-d]pyrimidine
- Molecular formula
- C7H4Cl2N2S
- Molecular weight
- 219.09
Names & synonyms
2,4-dichloro-7-methylthieno[3,2-d]pyrimidine35265-83-9DTXSID504280532,4-Dichloro-7-methylthieno(3,2-d)pyrimidineRefChem:246310DTXCID50378887888-318-3MFCD080612532,4-dichloro-7-methyl-thieno[3,2-d]pyrimidineSCHEMBL358761CS-M2510AKOS015919887
Show more names
2,4-Dichloro-7-methylthieno[3,2-d]pyrimidine-3Thieno[3,2-d]pyriMidine, 2,4-dichloro-7-Methyl-2,4-Dichloro-7-methylthieno[3,2-d]pyrimidine ISO 9001：2015 REACH
PB14528AC-30315DS-11392SY067296AMY55432,4-dichloro-7-me24-Dichloro-7-methylthieno[32-d]pyrimidine2,4-dichloro-7-metylthieno[3,2-d]pyrimidine
Database identifiers
- CAS
35265-83-9- PubChem CID
- 7147064
- DTXSID
DTXSID50428053- EC Number
- 888-318-3
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Boiling point
- 293 ℃ · 293℃
- Density
- 1.568 · 1.568
- Flash point
- 131 ℃ · 131℃
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- -0.48 · -0.48±0.40(Predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C7H4Cl2N2S/c1-3-2-12-5-4(3)10-7(9)11-6(5)8/h2H,1H3
- InChIKey
- WUXYWALKGQDXFI-UHFFFAOYSA-N
- SMILES
- C1(Cl)=NC(Cl)=C2SC=C(C)C2=N1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
- HS Code
- 2933399990 · 2933399990
Safety & regulation
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)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Applications
Uses2,4-Dichloro-7-methylthiopheno[3,2-D]pyrimidine is a heterocyclic derivative that can be used as an intermediate in organic synthesis.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers75 total
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
PharmOrgSyn Laboratories Co., Ltd.+86-021-38228826 +86-13916602830 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]
上海皓竹医药科技有限公司18912729622 · [email protected]
上海志甾生物科技有限公司
Related reactions
53 records
Compound notes
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