Basic information
- CAS
21472-86-6- Standard SMILES
Cc1cc(Cl)c(Cl)c(Cl)c1- InChIKey
DYBIAGHGODIVSM-UHFFFAOYSA-N- Molecular formula
- C7H5Cl3
- Average molar mass
- 195.5 g/mol
- Monoisotopic mass
- 193.9456832
Names & identifiers
- Preferred name
- 3,4,5-Trichlorotoluene
- IUPAC
- 1,2,3-trichloro-5-methylbenzene
- English name
- 3,4,5-Trichlorotoluene
- Molecular formula
- C7H5Cl3
- Molecular weight
- 195.47
Names & synonyms
3,4,5-Trichlorotoluene21472-86-6DTXSID30275300RefChem:1065671DTXCID402267471,2,3-trichloro-5-methylbenzeneMFCD136890081,2,3-trichloro-5-methyl-benzeneSCHEMBL900937SCHEMBL900938DYBIAGHGODIVSM-UHFFFAOYSA-NMSK14257
Show more names
Benzene, 1,2,3-trichloro-5-methyl-
CS-0191888E90884F629691
Database identifiers
- CAS
21472-86-6- PubChem CID
- 35397
- DTXSID
DTXSID30275300- Nikkaji
- J91.324C
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- Melting point
- 45.5 °C · 45.5°C
- Boiling point
- 230.4 °C · 230.4°C (estimate)
- Density
- 1.395 · 1.3950 (estimate)
- refractive index
- 1.567 · 1.5670 (estimate)
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
Chemistry & industry
Applications
Uses1,2,3-Trichloro-5-methylbenzene is useful in calculating 21 physical properties of organic compounds strictly from molecular structure.
Suppliers15 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京代盟化工有限公司025-66800956 18800000000 · [email protected]
河南普赛化工产品有限公司0371-63357898 · [email protected]
徐州睿诚致合生物医药技术有限公司15195955353 · [email protected]
杭州博洛科生物科技有限公司13757158499; 13757158499 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
河南利恩化工产品有限公司03716091-9097 13383857418 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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