Cas no 38303-36-5 (Pyrene, 1,3,6-tribromo-)
Pyrene, 1,3,6-tribromo- structure
Product Name:Pyrene, 1,3,6-tribromo-
CAS No:38303-36-5
MF:C16H7Br3
MW:438.9387819767
CID:321359
PubChem ID:3015969
Update Time:2025-04-19
Pyrene, 1,3,6-tribromo- Chemical and Physical Properties
Names and Identifiers
-
- Pyrene, 1,3,6-tribromo-
- 1,3,6-tribromopyrene
- 1,3,6-tribromo-pyrene
- 1,3,6-Tribrompyren
- 1,3,8-tribromopyrene
- 1,6,8-dibromopyrene
- 3,6,8-tribromopyrene
- EINECS 253-870-0
- Pyrene,1,3,6-tribromo
- 38303-36-5
- WJ355W8F3E
- Pyrene,1,3,6-tribromo-
- SCHEMBL2085261
- DTXSID30191677
- NS00006756
- XVBALZHPIPCRKD-UHFFFAOYSA-N
-
- Inchi： 1S/C16H7Br3/c17-12-6-2-8-1-3-10-13(18)7-14(19)11-5-4-9(12)15(8)16(10)11/h1-7H
- InChI Key： XVBALZHPIPCRKD-UHFFFAOYSA-N
- SMILES： BrC1=CC(=C2C=CC3=CC=C(C4=CC=C1C2=C43)Br)Br
Computed Properties
- Exact Mass: 435.81000
- Monoisotopic Mass: 435.809788
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 358
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0
- XLogP3: 7.1
Experimental Properties
- Density: 2.084
- Boiling Point: 509.9 °C at 760 mmHg
- Flash Point: 252.1 °C
- Refractive Index: 1.868
- PSA: 0.00000
- LogP: 6.87150
Pyrene, 1,3,6-tribromo- Customs Data
- HS CODE：2903999090
- Customs Data：
China Customs Code:
2903999090Overview:
2903999090 Other aromatic halogenated derivatives. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%
Pyrene, 1,3,6-tribromo- Related Literature
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Rajendra Kumar Konidena,K. R. Justin Thomas,Meenu Singh,Jwo-Huei Jou J. Mater. Chem. C 2016 4 4246
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2. Characterisation of 1,6- and 1,8-dibromopyrenesJames Grimshaw,J. Trocha-Grimshaw J. Chem. Soc. Perkin Trans. 1 1972 1622
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David E. Scott,Matthias Schulze,Jeffrey M. Stryker,Rik R. Tykwinski Chem. Soc. Rev. 2021 50 9202
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4. The optical properties and quantum chemical calculations of thienyl and furyl derivatives of pyreneKrzysztof R. Idzik,Piotr J. Cywiński,Wojciech Kuznik,Jaroslaw Frydel,Tobias Licha,Tomasz Ratajczyk Phys. Chem. Chem. Phys. 2015 17 22758
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