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418808-71-6 | 2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)aniline
CAS No: 418808-71-6 Catalog No: AG00BZ8D MDL No:MFCD00606391
Product Description
Catalog Number:
AG00BZ8D
Chemical Name:
2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)aniline
CAS Number:
418808-71-6
Molecular Formula:
C15H14N2O
Molecular Weight:
238.2845
MDL Number:
MFCD00606391
IUPAC Name:
2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)aniline
InChI:
InChI=1S/C15H14N2O/c1-9-3-6-14-13(7-9)17-15(18-14)11-4-5-12(16)10(2)8-11/h3-8H,16H2,1-2H3
InChI Key:
USNUQFSZYXTEED-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc(o2)c1ccc(c(c1)C)N
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.29g/mol
Monoisotopic Mass:
238.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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