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98236-09-0

98236-09-0 | Benzene, (2-iodo-1-methoxy-1-methylethyl)-

CAS No: 98236-09-0 Catalog No: AG005VNL MDL No:MFCD28149412

Product Description

Catalog Number:
AG005VNL
Chemical Name:
Benzene, (2-iodo-1-methoxy-1-methylethyl)-
CAS Number:
98236-09-0
Molecular Formula:
C10H13IO
Molecular Weight:
276.1141
MDL Number:
MFCD28149412
IUPAC Name:
(1-iodo-2-methoxypropan-2-yl)benzene
InChI:
InChI=1S/C10H13IO/c1-10(8-11,12-2)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChI Key:
WELIZGVJBZIGES-UHFFFAOYSA-N
SMILES:
ICC(c1ccccc1)(OC)C

Properties

Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.001g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.117g/mol
Monoisotopic Mass:
276.001g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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