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119297-96-0

119297-96-0 | 1-Octanol, 2-iodo-

CAS No: 119297-96-0 Catalog No: AG000IJ1 MDL No:

Product Description

Catalog Number:
AG000IJ1
Chemical Name:
1-Octanol, 2-iodo-
CAS Number:
119297-96-0
Molecular Formula:
C8H17IO
Molecular Weight:
256.1245
IUPAC Name:
2-iodooctan-1-ol
InChI:
InChI=1S/C8H17IO/c1-2-3-4-5-6-8(9)7-10/h8,10H,2-7H2,1H3
InChI Key:
LTCOJLUSXJQWIG-UHFFFAOYSA-N
SMILES:
CCCCCCC(CO)I

Properties

Complexity:
66.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.032g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.127g/mol
Monoisotopic Mass:
256.032g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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