Basic information
- CAS
580-51-8- Standard SMILES
Oc1cccc(-c2ccccc2)c1- InChIKey
UBXYXCRCOKCZIT-UHFFFAOYSA-N- Molecular formula
- C12H10O
- Average molar mass
- 170.21 g/mol
- Monoisotopic mass
- 170.07316494
Overview
Biphenyl-3-ol is a member of the class of hydroxybiphenyls that is phenol in which the hydrogen at position 3 has been replaced by a phenyl group.
Names & identifiers
- Preferred name
- 3-Phenylphenol
- IUPAC
- 3-phenylphenol
- English name
- 3-PHENYLPHENOL
- Molecular formula
- C12H10O
- Molecular weight
- 170.21
Names & synonyms
3-PHENYLPHENOL580-51-8[1,1'-Biphenyl]-3-ol3-Hydroxybiphenyl3-Biphenylolm-Phenylphenolm-Hydroxydiphenylm-Hydroxybiphenyl3-HydroxydiphenylDTXSID2022462(1,1'-Biphenyl)-3-olZU11X47H4O
Show more names
NSC 175883-BIPHENYOLm-Biphenylol
NSC-17588DTXCID602462RefChem:95336629-441-2Biphenyl-3-ol3-phenyl phenolMFCD00002294Phenol, m-phenyl-
Database identifiers
- CAS
580-51-8- PubChem CID
- 11381
- DTXSID
DTXSID2022462- ChEMBL
CHEMBL122570- ChEBI
CHEBI:34338- UNII
- ZU11X47H4O
- EC Number
- 629-441-2
- Nikkaji
- J1.630F
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 149
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP3.23
Collision Cross Section140.0 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID2022462]
Physicochemical properties
- Melting point
- 75 · 75-80 °C(lit.)
- Boiling point
- 120 · 120-130 °C
- Density
- 1.0149 · 1.0149 (rough estimate)
- refractive index
- 1.6188 · 1.6188 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- Crystalline Powder or Chunks
- pka
- 9.64 · 9.64(at 25℃)
- color
- White to yellow-beige
- BRN
- 1907938 · 1907938
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 44 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information[1,1'-Biphenyl]-3-ol: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29071990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
Chemistry & industry
Uses & manufacturing
General Manufacturing Information[1,1'-Biphenyl]-3-ol: INACTIVE
Applications
Uses3 -Phenylphenol is a sensitive colorimetric reagent, used for the analysis of uronic acid.
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海康朗生物科技有限公司021-61998208 18217752821 · [email protected]
合肥曼奇诺生物医药技术有限公司19719236623 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Related reactions
79 records
Compound notes
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