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67914-97-0 | 4-(4-Isopropylpiperazin-1-yl)phenol
CAS No: 67914-97-0 Catalog No: AG0036TI MDL No:
Product Description
Catalog Number:
AG0036TI
Chemical Name:
4-(4-Isopropylpiperazin-1-yl)phenol
CAS Number:
67914-97-0
Molecular Formula:
C13H20N2O
Molecular Weight:
220.3107
IUPAC Name:
4-(4-propan-2-ylpiperazin-1-yl)phenol
InChI:
InChI=1S/C13H20N2O/c1-11(2)14-7-9-15(10-8-14)12-3-5-13(16)6-4-12/h3-6,11,16H,7-10H2,1-2H3
InChI Key:
BMBPGRMBBHKAEP-UHFFFAOYSA-N
SMILES:
CC(N1CCN(CC1)c1ccc(cc1)O)C
EC Number:
267-750-0
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.158g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.316g/mol
Monoisotopic Mass:
220.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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