Basic information
- CAS
1133-63-7- Standard SMILES
Oc1cccc(-c2ccccc2)c1O- InChIKey
YKOQAAJBYBTSBS-UHFFFAOYSA-N- Molecular formula
- C12H10O2
- Average molar mass
- 186.21 g/mol
- Monoisotopic mass
- 186.06807956
Overview
Biphenyl-2,3-diol is a member of the class of hydroxybiphenyls that is 1,1'-biphenyl substituted by hydroxy groups at positions 2 and 3. It is a member of hydroxybiphenyls and a member of catechols.
Names & identifiers
- Preferred name
- 2,3-Dihydroxybiphenyl
- IUPAC
- 3-phenylbenzene-1,2-diol
- English name
- 2,3-DIHYDROXY-BIPHENYL
- Molecular formula
- C12H10O2
- Molecular weight
- 186.21
Names & synonyms
biphenyl-2,3-diol2,3-Biphenyldiol1133-63-7[1,1'-Biphenyl]-2,3-diol2,3-Dihydroxybiphenyl3-Phenylpyrocatechol3-phenylcatechol(1,1'-Biphenyl)-2,3-diolXQT8N5388ZCHEBI:16205DTXSID60150353RefChem:441901
Show more names
1,1'-biphenyl]-2,3-diol2,3-Biphenyldiol, 3-Phenylpyrocatechol2,3-Dihydroxy-biphenyl,2,3-Biphenyldiol, 3-Phenylpyrocatechol
DTXCID10728443-phenylbenzene-1,2-diol2,3-Dihydroxy-biphenyl1kmyUNII-XQT8N5388ZSCHEMBL94298SCHEMBL1396392SCHEMBL3989089
Database identifiers
- CAS
1133-63-7- PubChem CID
- 254
- DTXSID
DTXSID60150353- ChEBI
CHEBI:16205- UNII
- XQT8N5388Z
- EC Number
- 635-007-3
- Nikkaji
- J631.139C
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 108 · 108-113 °C
- Boiling point
- 352.9 · 352.9±30.0 °C(Predicted)
- Density
- 1.228 · 1.228±0.06 g/cm3(Predicted)
- pka
- 9.58 · 9.58±0.10(Predicted)
- BRN
- 1869593 · 1869593
- FDA UNII
- 8 N5388Z · XQT8N5388Z
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers13 total
Syntechem Co.,Ltd[email protected]
北京药素科技有限公司13051859142
BOC Sciences16314854226; +8616314854226 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
武汉鑫晟阳生物科技有限公司18402740988 18402740988 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Additional notes
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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