Home Halogens 4-(2-chloro-6-nitrophenyl)butan-2-ol

4-(2-chloro-6-nitrophenyl)butan-2-ol

CAS No.:
1343392-26-6
Catalog Number:
AG01AFUK
Molecular Formula:
C10H12ClNO3
Molecular Weight:
229.6602
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Product Description
Catalog Number:
AG01AFUK
Chemical Name:
4-(2-chloro-6-nitrophenyl)butan-2-ol
CAS Number:
1343392-26-6
Molecular Formula:
C10H12ClNO3
Molecular Weight:
229.6602
MDL Number:
MFCD18610132
IUPAC Name:
4-(2-chloro-6-nitrophenyl)butan-2-ol
InChI:
InChI=1S/C10H12ClNO3/c1-7(13)5-6-8-9(11)3-2-4-10(8)12(14)15/h2-4,7,13H,5-6H2,1H3
InChI Key:
QQNKXAHRMNALEZ-UHFFFAOYSA-N
SMILES:
CC(CCc1c(Cl)cccc1[N+](=O)[O-])O
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.051g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.66g/mol
Monoisotopic Mass:
229.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties