p-Nitrophenylvinyl sulfone(CAS No. 5535-55-7) CAS NO.5535-55-7

Min.Order: 1 Kilogram
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Product Details

Keywords

Benzene, 1- (ethenylsulfonyl)-4-nitro-
5535-55-7
98%

Quick Details

ProName: p-Nitrophenylvinyl sulfone(CAS No. 553...
CasNo: 5535-55-7
Molecular Formula: C8H7NO4S
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: according to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 1 Metric Ton/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Kilogram

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Details

【Name】
p-Nitrophenylvinyl sulfone
【Iupac name】
1-ethenylsulfonyl-4-nitrobenzene
【CAS Registry number】
5535-55-7
【Synonyms】
p-Nitrophenylvinyl sulfone
【Molecular Formula】
C8H7NO4S (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C8H7NO4S/c1-2-14(12,13)8-5-3-7(4-6-8)9(10)11/h2-6H,1H2
【Canonical SMILES】
C=CS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]
【MOL File】
5535-55-7.mol
Chemical and Physical Properties
【Density】
1.378g/cm3
【Boiling Point】
409.5°C at 760 mmHg
【Refractive Index】
1.568
【Flash Point】
201.5°C
【Computed Properties】
Molecular Weight:213.21048 [g/mol]
Molecular Formula:C8H7NO4S
XLogP3:1.8
H-Bond Donor:0
H-Bond Acceptor:4
Rotatable Bond Count:2
Exact Mass:213.009578
MonoIsotopic Mass:213.009578
Topological Polar Surface Area:88.3
Heavy Atom Count:14
Formal Charge:0
Complexity:316
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:4
Feature 3D Anion Count:1
Feature 3D Ring Count:1
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:1

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