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205325-37-7 | 2-HEXANOL, 1-[(PHENYLMETHYL)AMINO]-
CAS No: 205325-37-7 Catalog No: AG002A04 MDL No:
Product Description
Catalog Number:
AG002A04
Chemical Name:
2-HEXANOL, 1-[(PHENYLMETHYL)AMINO]-
CAS Number:
205325-37-7
Molecular Formula:
C13H21NO
Molecular Weight:
207.3119
IUPAC Name:
1-(benzylamino)hexan-2-ol
InChI:
InChI=1S/C13H21NO/c1-2-3-9-13(15)11-14-10-12-7-5-4-6-8-12/h4-8,13-15H,2-3,9-11H2,1H3
InChI Key:
HQBWWSLWQZDYQM-UHFFFAOYSA-N
SMILES:
CCCCC(CNCc1ccccc1)O
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.162g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.317g/mol
Monoisotopic Mass:
207.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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