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Home > Other Building Blocks > 113613-33-5
113613-33-5 | 2H-Oxirenium, 2,2,3-trimethyl- (9CI)
CAS No: 113613-33-5 Catalog No: AG00095Q MDL No:
Product Description
Catalog Number:
AG00095Q
Chemical Name:
2H-Oxirenium, 2,2,3-trimethyl- (9CI)
CAS Number:
113613-33-5
Molecular Formula:
C5H9O+
Molecular Weight:
85.1244
InChI:
InChI=1S/C5H9O/c1-4-5(2,3)6-4/h1-3H3/q+1
InChI Key:
POFRARSEPZJZLH-UHFFFAOYSA-N
SMILES:
CC1=[O+]C1(C)C
Properties
Complexity:
66.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
85.065g/mol
Formal Charge:
1
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
85.126g/mol
Monoisotopic Mass:
85.065g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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