Cyclopropanol,2,2-dibromo-, 1-acetate 5398-66-3

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1 Kilogram	Negotiable

1 Kilogram

Negotiable

Min.Order :1 Kilogram
Purity: 99%
Payment Terms : L/C,T/T,

Keywords

Cyclopropanol,2,2-dibromo-, 1-acetate 5398-66-3 C5H6 Br2 O2

Quick Details

Appearance:Solid
Application:Organic Chemicals
PackAge:as requested
ProductionCapacity:100|Kilogram|Month
Storage:room temperature
Transportation:as requested

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Details:

【Name】
Cyclopropanol,2,2-dibromo-, 1-acetate
【Iupac name】
(2,2-dibromocyclopropyl) acetate
【CAS Registry number】
5398-66-3
【Synonyms】
Cyclopropanol,2,2-dibromo-, acetate (9CI)
1,1-Dibromo-2-acetoxycyclopropane
NSC 4533
【Molecular Formula】
C5H6 Br2 O2 (Products with the same molecular formula)
【Molecular Weight】
257.9079
【Inchi】
InChI=1/C5H6Br2O2/c1-3(8)9-4-2-5(4,6)7/h4H,2H2,1H3
【Canonical SMILES】
CC(=O)OC1CC1(Br)Br
Chemical and Physical Properties
【Density】
2.07g/cm3
【Boiling Point】
217°C at 760 mmHg
【Refractive Index】
1.564
【Flash Point】
85°C
【Computed Properties】
Molecular Weight:257.90794 [g/mol]
Molecular Formula:C5H6Br2O2
XLogP3-AA:1.8
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:2
Exact Mass:257.871408
MonoIsotopic Mass:255.873455
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Formal Charge:0
Complexity:144
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Hydrophobe Count:3
Effective Rotor Count:2.6
Conformer Sampling RMSD:0.6
CID Conformer Count:4

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