4-Imidazolidineethanesulfonylazide, 2,5-dioxo- 5446-31-1 CAS NO.5446-31-1

Min.Order: 1 Gram
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Product Details

Keywords

4-Imidazolidineethanesulfonylazide, 2,5-dioxo-
5446-31-1
98%

Quick Details

ProName: 4-Imidazolidineethanesulfonylazide, 2,...
CasNo: 5446-31-1
Molecular Formula: C5H7 N5 O4 S
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: According to client's demand quantity
PackAge: As requested
Port: SHANGHAI
ProductionCapacity: 10 Kilogram/Month
Purity: 99%
Storage: Room Temperature
Transportation: as requested
LimitNum: 1 Gram
Heavy metal: N/A
Grade: Industrial Grade

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Details

【Name】
4-Imidazolidineethanesulfonylazide, 2,5-dioxo-
【CAS Registry number】
5446-31-1
【Synonyms】
4-Imidazolidineethanesulfonylazide, 2,5-dioxo-, (à)-
NSC 17200
【Molecular Formula】
C5H7 N5 O4 S (Products with the same molecular formula)
【Molecular Weight】
234.2126
【Inchi】
InChI=1/C5H7N5O4S/c6-9-10-15(13,14)2-1-3-4(11)8-5(12)7-3/h3,6H,1-2H2,(H-,7,8,11,12)/p+1
【Canonical SMILES】
C(CS(=O)(=O)N=[N+]=[N-])C1C(=O)NC(=O)N1
【Isomers smiles】
C(CS(=O)(=O)N=[N+]=[N-])C1C(=O)NC(=O)N1
Chemical and Physical Properties
【Computed Properties】
Molecular Weight:233.20518 [g/mol]
Molecular Formula:C5H7N5O4S
XLogP3-AA:0
H-Bond Donor:2
H-Bond Acceptor:6
Rotatable Bond Count:4
Tautomer Count:8
Exact Mass:233.021874
MonoIsotopic Mass:233.021874
Topological Polar Surface Area:115
Heavy Atom Count:15
Formal Charge:0
Complexity:431
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:4
Feature 3D Donor Count:3
Feature 3D Ring Count:1
Effective Rotor Count:4.6
Conformer Sampling RMSD:0.6
CID Conformer Count:166

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