Basic information
- CAS
17299-97-7- Standard SMILES
ClCc1cc(CCl)cc(CCl)c1- InChIKey
PJKMOHIGRNELRP-UHFFFAOYSA-N- Molecular formula
- C9H9Cl3
- Average molar mass
- 223.5 g/mol
- Monoisotopic mass
- 221.976983
Names & identifiers
- Preferred name
- 1,3,5-Tri(alpha-chloromethyl)benzene
- IUPAC
- 1,3,5-tris(chloromethyl)benzene
- English name
- 1,3,5-tris(chloromethyl)benzene
- Molecular formula
- C9H9Cl3
- Molecular weight
- 223.53
Names & synonyms
17299-97-71,3,5-TRI(ALPHA-CHLOROMETHYL)BENZENEDTXSID20169486NSC 46592RefChem:217197DTXCID10919771,3,5-tris(chloromethyl)benzeneBenzene,1,3,5-tris(chloromethyl)-Benzene, 1,3,5-tris-(chloromethyl)NSC46592Benzene, 1,3,5-tris(chloromethyl)-1,3,5-trichloromethylbenzene
Show more names
SCHEMBL1050358SCHEMBL3169852PJKMOHIGRNELRP-UHFFFAOYSA-NMFCD08067356NSC-46592SY522671DS-000326I83970
Database identifiers
- CAS
17299-97-7- PubChem CID
- 28451
- DTXSID
DTXSID20169486- Nikkaji
- J1.512.104A
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 91.2
Physicochemical properties
- 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
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
郑州研德生物科技有限公司13298105281 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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