Home Sulfos 4-(pentyloxy)-3-(propan-2-yl)benzene-1-sulfonyl chloride

4-(pentyloxy)-3-(propan-2-yl)benzene-1-sulfonyl chloride

CAS No.:
1094512-16-9
Catalog Number:
AG01EIZ7
Molecular Formula:
C14H21ClO3S
Molecular Weight:
304.8327
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Product Description
Catalog Number:
AG01EIZ7
Chemical Name:
4-(pentyloxy)-3-(propan-2-yl)benzene-1-sulfonyl chloride
CAS Number:
1094512-16-9
Molecular Formula:
C14H21ClO3S
Molecular Weight:
304.8327
MDL Number:
MFCD12550995
IUPAC Name:
4-pentoxy-3-propan-2-ylbenzenesulfonyl chloride
InChI:
InChI=1S/C14H21ClO3S/c1-4-5-6-9-18-14-8-7-12(19(15,16)17)10-13(14)11(2)3/h7-8,10-11H,4-6,9H2,1-3H3
InChI Key:
TWZKVAWLZZLAAX-UHFFFAOYSA-N
SMILES:
CCCCCOc1ccc(cc1C(C)C)S(=O)(=O)Cl
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.09g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.829g/mol
Monoisotopic Mass:
304.09g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties