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1206976-31-9 | (2-PROPYL-1,3-OXAZOL-5-YL)ACETONITRILE
CAS No: 1206976-31-9 Catalog No: AG01BK2H MDL No:MFCD22550204
Product Description
Catalog Number:
AG01BK2H
Chemical Name:
(2-PROPYL-1,3-OXAZOL-5-YL)ACETONITRILE
CAS Number:
1206976-31-9
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
MDL Number:
MFCD22550204
IUPAC Name:
2-(2-propyl-1,3-oxazol-5-yl)acetonitrile
InChI:
InChI=1S/C8H10N2O/c1-2-3-8-10-6-7(11-8)4-5-9/h6H,2-4H2,1H3
InChI Key:
DFFOJRRXWACIAI-UHFFFAOYSA-N
SMILES:
CCCc1ncc(o1)CC#N
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.181g/mol
Monoisotopic Mass:
150.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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