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138452-75-2 | Phenol, 3-(pentylamino)-
CAS No: 138452-75-2 Catalog No: AG00196A MDL No:
Product Description
Catalog Number:
AG00196A
Chemical Name:
Phenol, 3-(pentylamino)-
CAS Number:
138452-75-2
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
IUPAC Name:
3-(pentylamino)phenol
InChI:
InChI=1S/C11H17NO/c1-2-3-4-8-12-10-6-5-7-11(13)9-10/h5-7,9,12-13H,2-4,8H2,1H3
InChI Key:
ZHORLLDLRQFJAM-UHFFFAOYSA-N
SMILES:
CCCCCNc1cccc(c1)O
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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