Basic information
- CAS
34244-14-9- Standard SMILES
Clc1ccc2ccc3cccc4ccc1c2c34- InChIKey
WNYHOOQHJMHHQW-UHFFFAOYSA-N- Molecular formula
- C16H9Cl
- Average molar mass
- 236.69 g/mol
- Monoisotopic mass
- 236.039278
Overview
structure given in first source
Names & identifiers
- Preferred name
- 1-Chloropyrene
- IUPAC
- 1-chloropyrene
- English name
- 1-CHLOROPYRENE
- Molecular formula
- C16H9Cl
- Molecular weight
- 236.7
Names & synonyms
1-CHLOROPYRENE34244-14-93-ChloropyrenePyrene, 1-chloro-ECZ7RUY70MDTXSID70187817NSC-33062RefChem:75463DTXCID301103081-Chloropyrene (~80%)chloropyreneMFCD00014327
Show more names
1-chloro-pyrenTIMTEC-BB SBB0081691-Chloropyrene in toluene1-Chloropyrene in isooctane1-Chloropyrene 50 μg/mL In Toluene1-Chloropyrene - Technical (min 80%)
CCRIS 5545NSC 33062C16H9ClBRN 1875844Pyrene, 1-chloro-; 1-Chloropyrene; 3-Chloropyrene; NSC 33062WNYHOOQHJMHHQW-UHFFFAOYSA-NUNII-ECZ7RUY70MSCHEMBL176331
Database identifiers
- CAS
34244-14-9- PubChem CID
- 36730
- DTXSID
DTXSID70187817- UNII
- ECZ7RUY70M
- Nikkaji
- J66.503G
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 300
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Physicochemical properties
- Melting point
- 119 °C · 119°C
- Boiling point
- 307.92 °C · 307.92°C (rough estimate)
- Density
- 1.1813 · 1.1813 (rough estimate)
- refractive index
- 1.6281 · 1.6281 (estimate)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Acetone (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- color
- Off-White to Dark Orange
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 7 RUY70M · ECZ7RUY70M
Chemistry & industry
Applications
Uses1-Chloropyrene is a pollutant and is part of the chlorinated polycyclic aromatic hydrocarbons that is an emerging class of environmental contaminants.
Suppliers18 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
上海稳同科技有限公司02151600108 13062666369 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
热耳科技（上海）有限公司021-64400900 15800436310 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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