Basic information
- CAS
64037-12-3- Standard SMILES
Nc1nc2cc(Cl)c(Cl)cc2o1- InChIKey
IHWQUKMGROAAEH-UHFFFAOYSA-N- Molecular formula
- C7H4Cl2N2O
- Average molar mass
- 203.02 g/mol
- Monoisotopic mass
- 201.9700681
Names & identifiers
- Preferred name
- 5,6-Dichloro-2-benzoxazolamine
- IUPAC
- 5,6-dichloro-1,3-benzoxazol-2-amine
- English name
- 5,6-Dichloro-2-benzoxazolamine
- Molecular formula
- C7H4Cl2N2O
- Molecular weight
- 203.03
Names & synonyms
64037-12-3BENZOXAZOLE, 2-AMINO-5,6-DICHLORO-5,6-Dichloro-2-benzoxazolamineDTXSID50214034RefChem:1072182DTXCID501365255,6-dichloro-1,3-benzoxazol-2-amine5,6-Dichlorobenzo[d]oxazol-2-amine2-Amino-5,6-dichlorobenzoxazoleSCHEMBL10981532MFCD01664141BS-29243
Show more names
2-Benzoxazolamine,5,6-dichloro-
DB-306327
Database identifiers
- CAS
64037-12-3- PubChem CID
- 46385
- DTXSID
DTXSID50214034- Nikkaji
- J67.894E
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Boiling point
- 2.4 °C · 2.4°C (rough estimate)
- Density
- 1.5053 · 1.5053 (rough estimate)
- refractive index
- 1.55 · 1.5500 (estimate)
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- Brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers8 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
湖北省善乐兴生物科技有限公司18321145570 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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