Home Halogens 4-{[1-(2-chlorophenyl)ethyl]amino}butan-2-ol

4-{[1-(2-chlorophenyl)ethyl]amino}butan-2-ol

CAS No.:
1344279-75-9
Catalog Number:
AG01AW2B
Molecular Formula:
C12H18ClNO
Molecular Weight:
227.7304
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Product Description
Catalog Number:
AG01AW2B
Chemical Name:
4-{[1-(2-chlorophenyl)ethyl]amino}butan-2-ol
CAS Number:
1344279-75-9
Molecular Formula:
C12H18ClNO
Molecular Weight:
227.7304
MDL Number:
MFCD20439006
IUPAC Name:
4-[1-(2-chlorophenyl)ethylamino]butan-2-ol
InChI:
InChI=1S/C12H18ClNO/c1-9(15)7-8-14-10(2)11-5-3-4-6-12(11)13/h3-6,9-10,14-15H,7-8H2,1-2H3
InChI Key:
GDXOJKNKDADUND-UHFFFAOYSA-N
SMILES:
CC(CCNC(c1ccccc1Cl)C)O
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.108g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.732g/mol
Monoisotopic Mass:
227.108g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties