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1017134-27-8 | 2H-Pyran-4-amine, tetrahydro-4-(phenylmethyl)-
CAS No: 1017134-27-8 Catalog No: AG0005A2 MDL No:MFCD09888736
Product Description
Catalog Number:
AG0005A2
Chemical Name:
2H-Pyran-4-amine, tetrahydro-4-(phenylmethyl)-
CAS Number:
1017134-27-8
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
MDL Number:
MFCD09888736
IUPAC Name:
4-benzyloxan-4-amine
InChI:
InChI=1S/C12H17NO/c13-12(6-8-14-9-7-12)10-11-4-2-1-3-5-11/h1-5H,6-10,13H2
InChI Key:
FFLWOVARGIKKFZ-UHFFFAOYSA-N
SMILES:
NC1(CCOCC1)Cc1ccccc1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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