Home Other Building Blocks 3-Chloro-4,5-dihydro-5,5-dimethylisoxazole

3-Chloro-4,5-dihydro-5,5-dimethylisoxazole

CAS No.:
326829-08-7
Catalog Number:
AG0037OF
Molecular Formula:
C5H8ClNO
Molecular Weight:
133.5761
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Product Description
Catalog Number:
AG0037OF
Chemical Name:
3-Chloro-4,5-dihydro-5,5-dimethylisoxazole
CAS Number:
326829-08-7
Molecular Formula:
C5H8ClNO
Molecular Weight:
133.5761
MDL Number:
MFCD27997642
IUPAC Name:
3-chloro-5,5-dimethyl-4H-1,2-oxazole
InChI:
InChI=1S/C5H8ClNO/c1-5(2)3-4(6)7-8-5/h3H2,1-2H3
InChI Key:
YMCWJQIZJIKFHO-UHFFFAOYSA-N
SMILES:
ClC1=NOC(C1)(C)C
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.029g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
133.575g/mol
Monoisotopic Mass:
133.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties