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14775-98-5 | "3-(2-chloroethyl)-5-methyl-1,2-oxazole"
CAS No: 14775-98-5 Catalog No: AG01FLRV MDL No:MFCD19234148
Product Description
Catalog Number:
AG01FLRV
Chemical Name:
"3-(2-chloroethyl)-5-methyl-1,2-oxazole"
CAS Number:
14775-98-5
Molecular Formula:
C6H8ClNO
Molecular Weight:
145.5868
MDL Number:
MFCD19234148
IUPAC Name:
3-(2-chloroethyl)-5-methyl-1,2-oxazole
InChI:
InChI=1S/C6H8ClNO/c1-5-4-6(2-3-7)8-9-5/h4H,2-3H2,1H3
InChI Key:
PLACIJCHEBUTIO-UHFFFAOYSA-N
SMILES:
Cc1cc(no1)CCCl
Properties
Complexity:
89.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.029g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.586g/mol
Monoisotopic Mass:
145.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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