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2,2'-Dimethyl-1,1'-binaphthalene

2,2'-Dimethyl-1,1'-binaphthalene - CAS 60536-98-3

Catalog:	BB030717
Product Name:	2,2'-Dimethyl-1,1'-binaphthalene
CAS:	60536-98-3
Synonyms:	2-methyl-1-(2-methylnaphthalen-1-yl)naphthalene

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Computed Properties

IUPAC Name:	2-methyl-1-(2-methylnaphthalen-1-yl)naphthalene
Description:	2,2'-Dimethyl-1,1'-binaphthalene (CAS# 60536-98-3) is a compound useful in organic synthesis.
Molecular Weight:	282.38
Molecular Formula:	C22H18
Canonical SMILES:	CC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)C
InChI:	InChI=1S/C22H18/c1-15-11-13-17-7-3-5-9-19(17)21(15)22-16(2)12-14-18-8-4-6-10-20(18)22/h3-14H,1-2H3
InChI Key:	KDHFKMDVFWYSPT-UHFFFAOYSA-N
Boiling Point:	190-210 °C / 0.2 mmHg (lit.)
MDL:	MFCD01863647
LogP:	6.27680

Publication Number	Title	Priority Date
CN-113045600-A	Preparation method of axial chiral methylene cyclohexane derivative	20210322
JP-2021143280-A	Damping agent and damping material	20200312
CN-111662331-A	Phosphine ligand, preparation method thereof and application of phosphine ligand in catalytic synthesis of ortho-tetra-substituted biaryl	20190305
WO-2020177654-A1	Phosphine ligand and preparation method thereof, and application in catalytic synthesis of ortho-tetra-substituted biaromatics	20190305
EP-3498356-A1	Chiral separation and analysis by molecular propeller effect	20171212

PMID	Publication Date	Title	Journal
19555058	20090803	Asymmetric synthesis of bis(tertiary arsines): highly stereoselective alkylations of diastereomers of a chiral phosphine-stabilized bis(arsenium triflate)	Inorganic chemistry

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	336
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	282.140850574
Formal Charge:	0
Heavy Atom Count:	22
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	282.140850574
Rotatable Bond Count:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	6.8