Basic information
- CAS
1636-34-6- Standard SMILES
CC(O)(c1ccccc1)C(C)(O)c1ccccc1- InChIKey
URPRLFISKOCZHR-UHFFFAOYSA-N- Molecular formula
- C16H18O2
- Average molar mass
- 242.31 g/mol
- Monoisotopic mass
- 242.13067981
Names & identifiers
- Preferred name
- 2,3-Diphenyl-2,3-butanediol
- IUPAC
- 2,3-diphenylbutane-2,3-diol
- English name
- 2,3-Diphenyl-2,3-butanediol
- Molecular formula
- C16H18O2
- Molecular weight
- 242.31
Names & synonyms
2,3-Diphenylbutane-2,3-diol1636-34-62,3-Diphenyl-2,3-butanediolDTXSID70936847RefChem:1059497DTXCID80893114216-665-72,3-Butanediol, 2,3-diphenyl-Acetophenonepinacol2,3-diphenyl-2,3-dihydroxybutaneMFCD00004452NSC54029
Show more names
SKL2232,3-diphenyl-2,3-butyldiol2,3-Dihydroxy-2,3-diphenylbutane1,2-Diphenyl-1,2-dimethyl-1,2-ethanediol1,2-Dimethyl-1,2-diphenylethylene glycol
TimTec1_004660SCHEMBL16174432,3-diphenyl-butane-2,3-diolNSC 928232, 2,3-diphenyl-CS-0447832acetophenone pinacolEINECS 216-665-7
Database identifiers
- CAS
1636-34-6- PubChem CID
- 97886
- DTXSID
DTXSID70936847- EC Number
- 216-665-7
- Nikkaji
- J103.045K
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 238
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 93 · 93-96 °C
- Boiling point
- 140 · 140-144 °C(Press: 1.5 Torr)
- Density
- 1.139 · 1.139±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.99 · 13.99±0.29(Predicted)
- Appearance
- White to off-white Solid
- BRN
- 1878154 · 1878154
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers29 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Syntechem Co.,Ltd[email protected]
河南伊诺凯新材料有限公司13290191024 13290191024 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
南京克迪特贸易有限公司025-52164950 · [email protected]
南京大唐医药科技有限公司025-84341491 13951930983 · [email protected]
台州川旭医药科技有限公司[email protected] 15165038510 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海易恩化学技术有限公司400-400-1332688 18019345275 · [email protected]
河南威梯希化工科技有限公司0371-63284658 18135795563 · [email protected]
武汉爱默尔特科技有限公司027-888-4366503 13986279625 · [email protected]
Aladdin Scientific[email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
广州市禄涞医药科技有限公司13660253774 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
Related reactions
3 records
Compound notes
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