4-Bromo-1,1':3',1''-terphenyl - CAS 54590-37-3
Catalog: |
BB028727 |
Product Name: |
4-Bromo-1,1':3',1''-terphenyl |
CAS: |
54590-37-3 |
Synonyms: |
1-bromo-4-(3-phenylphenyl)benzene |
IUPAC Name: | 1-bromo-4-(3-phenylphenyl)benzene |
Description: | 4-Bromo-1,1':3',1''-terphenyl (CAS# 54590-37-3) is a useful research chemical. |
Molecular Weight: | 309.20 |
Molecular Formula: | C18H13Br |
Canonical SMILES: | C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=C(C=C3)Br |
InChI: | InChI=1S/C18H13Br/c19-18-11-9-15(10-12-18)17-8-4-7-16(13-17)14-5-2-1-3-6-14/h1-13H |
InChI Key: | XWHCOAVJEOENNM-UHFFFAOYSA-N |
LogP: | 5.78310 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112479902-A | Compound for organic photoelectric device, organic photoelectric device and display device | 20190911 |
KR-20210031332-A | Compound for organic optoelectronic device and organic optoelectronic device and display device | 20190911 |
US-2021070689-A1 | Compound for organic optoelectronic device and organic optoelectronic device and display device | 20190911 |
TW-202044640-A | Organic light emitting device | 20190228 |
US-2020212307-A1 | Condensed cyclic compound, composition including the same, and organic light-emitting device including the condensed cyclic compound | 20181228 |
Complexity: | 261 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 308.02006 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 308.02006 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.9 |
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