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Substance Name: Bibenzyl
RN: 103-29-7
UNII: 007C07V77Z
InChIKey: QWUWMCYKGHVNAV-UHFFFAOYSA-N
Note
- Intermdiate in biosynthesis of dihydrophenanthrenes from phenylalanine.
Molecular Formula
- C14-H14
Molecular Weight
- 182.265
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 1,2-Dihydrostilbene
- Bibenzyl
Synonyms
- 1,2-Diphenylethane
- 1,2-Diphenylethane, s
- AI3-06161
- Benzene, 1,1'-(1,2-ethanediyl)bis-
- Bibenzyl
- Dibenzil
- Dibenzyl
- Dihydrostilbene
- EINECS 203-096-4
- Ethane, 1,2-diphenyl-
- NSC 30686
- s-Diphenylethane
- sym-Diphenylethane
- UNII-007C07V77Z
Systematic Names
- 1,2-Diphenylethane
- Benzene, 1,1'-(1,2-ethanediyl)bis-
- Bibenzyl
Registry Numbers
CAS Registry Number
- 103-29-7
FDA UNII
- 007C07V77Z
Other Registry Number
- 39660-70-3
System Generated Number
- 0000103297
Structure Descriptors
InChI
1S/C14H14/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-10H,11-12H2InChIKey
QWUWMCYKGHVNAV-UHFFFAOYSA-NSmiles
c1(CCc2ccccc2)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 2500mg/kg (2500mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 19, Pg. 617, 1969. | |
| mouse | LD50 | intravenous | 78mg/kg (78mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 19, Pg. 617, 1969. | |
| rabbit | LD50 | skin | > 5gm/kg (5000mg/kg) | National Technical Information Service. Vol. OTS0570799, | |
| rat | LD50 | oral | 4518mg/kg (4518mg/kg) | BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" | National Technical Information Service. Vol. OTS0570799, |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 52.5 | deg C | EXP | |
| Boiling Point | 284 | deg C | EXP | |
| log P (octanol-water) | 4.79 | (none) | EXP | |
| Water Solubility | 4.3 | mg/L | 25 | EXP |
| Henry's Law Constant | 6.37E-04 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 1.20E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.