[1,1'-Biphenyl]-3-methanol, 2-methyl-

HCID 596875CAS 76350-90-8
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1c(CO)cccc1-c1ccccc1
InChIKey
BGTLHJPGBIVQLJ-UHFFFAOYSA-N
Molecular formula
C14H14O
Average molar mass
198.26 g/mol
Monoisotopic mass
198.10446507

Names & identifiers

Preferred name
[1,1'-Biphenyl]-3-methanol, 2-methyl-
IUPAC
(2-methyl-3-phenylphenyl)methanol
English name
2-Methyl-3-biphenylmethanol
Molecular formula
C14H14O
Molecular weight
198.26

Names & synonyms

(2-Methyl-[1,1'-biphenyl]-3-yl)methanol[1,1'-Biphenyl]-3-methanol, 2-methyl-2-Methyl[1,1'-biphenyl]-3-methanol(1,1'-Biphenyl)-3-methanol, 2-methyl-{2-METHYL-[1,1'-BIPHENYL]-3-YL}METHANOLDTXSID30741012-Methyl(1,1'-biphenyl)-3-methanol(2-methyl-(1,1'-biphenyl)-3-yl)methanolRefChem:550932DTXCID5047873965-375-376350-90-8
Show more names
Bifenthrin alcohol2-methyl-3-biphenylmethyanolBiphenyl alcoholbiphenylmethyanol2-Methyl-3-biphenylm2-Methyl-3-phenylbenzyl Alcohol
2-Methyl-3-biphenylmethanol3-Hydroxymethyl-2-methylbiphenyl(2-methyl-3-phenylphenyl)methanol(2-Methyl-3-biphenylyl)methanol2-Methylbiphenyl-3-methanolMFCD00134200SCHEMBL358303CHEMBL4092122

Database identifiers

CAS
76350-90-8
PubChem CID
596875
DTXSID
DTXSID3074101
ChEMBL
CHEMBL4092122
EC Number
965-375-3
Nikkaji
J383.005E

Properties

Computed structural properties

XLogP
3
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
15

Experimental & physicochemical properties

PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
Endocrine DisruptorsPotential endocrine disrupting compound

Physicochemical properties

Melting point
73 · 73-76 °C(lit.)
Boiling point
330.9 · 330.9±11.0 °C(Predicted)
Density
1.072 · 1.072±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
solubility
Chloroform (Slightly), Methanol (Slightly)
form
Solid

Safety & regulation

GHS classification

GHS Classification · 4 items

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk
3
tsca
TSCA listed
hs_code
2906290090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335

Chemistry & industry

Uses & manufacturing

Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
General Manufacturing Information[1,1'-Biphenyl]-3-methanol, 2-methyl-: ACTIVE
Applications · 2 items

Description2-Methyl-3-biphenylmethanol is a pharmaceutical intermediate and organic chemical synthesis reagent, which can be used in the preparation of drugs such as Bifenthrin and PD-L1 inhibitors, and also in the synthesis of other organic compounds such as 2-methyl-3-phenylphenethylboronic acid pinacol ester, biphenyl-1,2,3-triazole couplings and biphenyl alcohols.

UsesBifenthrin intermediate.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Related reactions

12 records
New reaction record

Linked notes

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