Benzeneacetic acid, a,a-diphenyl-, methyl ester(CAS No. 5467-21-0) CAS NO.5467-21-0

Min.Order Quantity:: 1 Gram

Purity:: 99%

Port:: SHANGHAI

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Keywords

Benzeneacetic acid, a,a-diphenyl-, methyl ester
5467-21-0
98%

Quick Details

ProName: Benzeneacetic acid, a,a-diphenyl-, met...
CasNo: 5467-21-0
Molecular Formula: C21H18 O2
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: according to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram

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Details

【name】
benzeneacetic acid, a,a-diphenyl-, methyl ester
【iupac name】
methyl 2,2,2-triphenylacetate
【cas registry number】
5467-21-0
【synonyms】
aceticacid, triphenyl-, methyl ester (6ci,7ci,8ci)
methyl triphenylacetate
nsc28082
triphenylacetic acid methyl ester
【molecular formula】
c21h18 o2 (products with the same molecular formula)
【molecular weight】
302.36642
【inchi】
inchi=1/c21h18o2/c1-23-20(22)21(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16h,1h3
【canonical smiles】
coc(=o)c(c1=cc=cc=c1)(c2=cc=cc=c2)c3=cc=cc=c3
【mol file】
5467-21-0.mol
chemical and physical properties
【density】
1.122g/cm3
【boiling point】
416.8°cat760mmhg
【refractive index】
1.587
【flash point】
148°c
【computed properties】
molecular weight:302.36642 [g/mol]
molecular formula:c21h18o2
xlogp3-aa:4.9
h-bond donor:0
h-bond acceptor:2
rotatable bond count:5
exact mass:302.13068
monoisotopic mass:302.13068
topological polar surface area:26.3
heavy atom count:23
formal charge:0
complexity:326
isotope atom count:0
defined atom stereocenter count:0
undefined atom stereocenter count:0
defined bond stereocenter count:0
undefined bond stereocenter count:0
covalently-bonded unit count:1
feature 3d acceptor count:1
feature 3d ring count:3
effective rotor count:5
conformer sampling rmsd:0.8
cid conformer count:3