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1217702-12-9 | Cyclohexanemethanamine, 4-(5-methyl-2-benzoxazolyl)-, trans-
CAS No: 1217702-12-9 Catalog No: AG0015WB MDL No:MFCD12026775
Product Description
Catalog Number:
AG0015WB
Chemical Name:
Cyclohexanemethanamine, 4-(5-methyl-2-benzoxazolyl)-, trans-
CAS Number:
1217702-12-9
Molecular Formula:
C15H20N2O
Molecular Weight:
244.3321
MDL Number:
MFCD12026775
IUPAC Name:
[4-(5-methyl-1,3-benzoxazol-2-yl)cyclohexyl]methanamine
InChI:
InChI=1S/C15H20N2O/c1-10-2-7-14-13(8-10)17-15(18-14)12-5-3-11(9-16)4-6-12/h2,7-8,11-12H,3-6,9,16H2,1H3
InChI Key:
DAZIVKWNLZVHJC-UHFFFAOYSA-N
SMILES:
NC[C@@H]1CC[C@H](CC1)c1nc2c(o1)ccc(c2)C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.338g/mol
Monoisotopic Mass:
244.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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