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88692-72-2

88692-72-2 | 2-Propanol, 1-[(3-iodo-2-propynyl)oxy]-

CAS No: 88692-72-2 Catalog No: AG0046MK MDL No:

Product Description

Catalog Number:
AG0046MK
Chemical Name:
2-Propanol, 1-[(3-iodo-2-propynyl)oxy]-
CAS Number:
88692-72-2
Molecular Formula:
C6H9IO2
Molecular Weight:
240.0389
IUPAC Name:
1-(3-iodoprop-2-ynoxy)propan-2-ol
InChI:
InChI=1S/C6H9IO2/c1-6(8)5-9-4-2-3-7/h6,8H,4-5H2,1H3
InChI Key:
XEGJXCQVHDTILJ-UHFFFAOYSA-N
SMILES:
CC(COCC#CI)O

Properties

Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.965g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.04g/mol
Monoisotopic Mass:
239.965g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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