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1315449-52-5 | 4-[5-(propan-2-yl)-1,3-oxazol-2-yl]aniline
CAS No: 1315449-52-5 Catalog No: AG01ADU0 MDL No:MFCD20391123
Product Description
Catalog Number:
AG01ADU0
Chemical Name:
4-[5-(propan-2-yl)-1,3-oxazol-2-yl]aniline
CAS Number:
1315449-52-5
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
MDL Number:
MFCD20391123
IUPAC Name:
4-(5-propan-2-yl-1,3-oxazol-2-yl)aniline
InChI:
InChI=1S/C12H14N2O/c1-8(2)11-7-14-12(15-11)9-3-5-10(13)6-4-9/h3-8H,13H2,1-2H3
InChI Key:
VRTNZULDOLXXQW-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1ncc(o1)C(C)C
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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