Home Halogens 5-tert-butyl-2-(1-chloroethyl)-1,3-oxazole

5-tert-butyl-2-(1-chloroethyl)-1,3-oxazole

CAS No.:
1133001-05-4
Catalog Number:
AG019TMZ
Molecular Formula:
C9H14ClNO
Molecular Weight:
187.6666
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Product Description
Catalog Number:
AG019TMZ
Chemical Name:
5-tert-butyl-2-(1-chloroethyl)-1,3-oxazole
CAS Number:
1133001-05-4
Molecular Formula:
C9H14ClNO
Molecular Weight:
187.6666
MDL Number:
MFCD12131302
IUPAC Name:
5-tert-butyl-2-(1-chloroethyl)-1,3-oxazole
InChI:
InChI=1S/C9H14ClNO/c1-6(10)8-11-5-7(12-8)9(2,3)4/h5-6H,1-4H3
InChI Key:
NGJCDWDWDLCMNH-UHFFFAOYSA-N
SMILES:
CC(c1ncc(o1)C(C)(C)C)Cl
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.076g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.667g/mol
Monoisotopic Mass:
187.076g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties