Home Halogens 3-(chloromethyl)-2,2-dimethyl-oxirane

3-(chloromethyl)-2,2-dimethyl-oxirane

CAS No.:
79457-63-9
Catalog Number:
AG0058LH
Molecular Formula:
C5H9ClO
Molecular Weight:
120.5774
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Product Description
Catalog Number:
AG0058LH
Chemical Name:
3-(chloromethyl)-2,2-dimethyl-oxirane
CAS Number:
79457-63-9
Molecular Formula:
C5H9ClO
Molecular Weight:
120.5774
MDL Number:
MFCD19232129
IUPAC Name:
3-(chloromethyl)-2,2-dimethyloxirane
InChI:
InChI=1S/C5H9ClO/c1-5(2)4(3-6)7-5/h4H,3H2,1-2H3
InChI Key:
CHKXVLMZDALGOS-UHFFFAOYSA-N
SMILES:
ClCC1OC1(C)C
NSC Number:
326135
Properties
Complexity:
80.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.034g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
120.576g/mol
Monoisotopic Mass:
120.034g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties