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832733-80-9 | Phenol, 2-(butylamino)-5-chloro-
CAS No: 832733-80-9 Catalog No: AG004XVS MDL No:
Product Description
Catalog Number:
AG004XVS
Chemical Name:
Phenol, 2-(butylamino)-5-chloro-
CAS Number:
832733-80-9
Molecular Formula:
C10H14ClNO
Molecular Weight:
199.6773
IUPAC Name:
2-(butylamino)-5-chlorophenol
InChI:
InChI=1S/C10H14ClNO/c1-2-3-6-12-9-5-4-8(11)7-10(9)13/h4-5,7,12-13H,2-3,6H2,1H3
InChI Key:
QXZZMOGOUXMPNN-UHFFFAOYSA-N
SMILES:
CCCCNc1ccc(cc1O)Cl
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.076g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.678g/mol
Monoisotopic Mass:
199.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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