Basic information
- CAS
2198-77-8- Standard SMILES
Clc1ccc2ccc(Cl)cc2c1- InChIKey
DWBQZSYTSNYEEJ-UHFFFAOYSA-N- Molecular formula
- C10H6Cl2
- Average molar mass
- 197.06 g/mol
- Monoisotopic mass
- 195.9846556
Names & identifiers
- Preferred name
- 2,7-Dichloronaphthalene
- IUPAC
- 2,7-dichloronaphthalene
- English name
- 2,7-dichloronaphthalene
- Molecular formula
- C10H6Cl2
- Molecular weight
- 197.06
Names & synonyms
2,7-DICHLORONAPHTHALENENaphthalene, 2,7-dichloro-NSC 112382DTXSID7062247EINECS 218-605-5RefChem:83413DTXCID2036584218-605-5DWBQZSYTSNYEEJ-UHFFFAOYSA-N2198-77-8CHEMBL1947112,7-Dichlornaphthalin
Show more names
PCN 12DICHLORONAPTHALENE
NSC1123822,7-Dichlor-naphthalinNaphthalene,7-dichloro-2,7-Dichloro-naphthaleneSCHEMBL1392832SCHEMBL2473615SCHEMBL9653515SCHEMBL30027002
Database identifiers
- CAS
2198-77-8- PubChem CID
- 16619
- DTXSID
DTXSID7062247- ChEMBL
CHEMBL194711- EC Number
- 218-605-5
- Nikkaji
- J134.683K
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 142
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP4.81
Physicochemical properties
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
- Henry's Law Constant
- 3.1 · 3.1×10-2 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- EPA Substance Registry System
- 2 · Naphthalene, 2,7-dichloro- (2198-77-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
SP - indicates a substance that is identified in a proposed Significant New Use Rule.
Substance: 2,7-dichloronaphthalene
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationNaphthalene, 2,7-dichloro-: ACTIVE
Applications
Uses2,7-Dichloronaphthalene is a standard for environmental testing and research. Studies on the metabolism of chloronapthalenes and dichoronaphthalene metabolite. Determination of polychlorinated naphthalenes in flue gas samples by HRGC/HRMS isotope internal stanadard method.
Suppliers5 total
常州宣叶科技有限公司15195022192 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
海蔚化学86-21-51086038 · [email protected]
南通玖跃科技有限公司13813620371 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…