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20483-76-5 | 3-Butyn-2-ol, 4-iodo-2-methyl-
CAS No: 20483-76-5 Catalog No: AG0029QH MDL No:
Product Description
Catalog Number:
AG0029QH
Chemical Name:
3-Butyn-2-ol, 4-iodo-2-methyl-
CAS Number:
20483-76-5
Molecular Formula:
C5H7IO
Molecular Weight:
210.0129
IUPAC Name:
4-iodo-2-methylbut-3-yn-2-ol
InChI:
InChI=1S/C5H7IO/c1-5(2,7)3-4-6/h7H,1-2H3
InChI Key:
OVVARGOJXLEZDW-UHFFFAOYSA-N
SMILES:
IC#CC(O)(C)C
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.954g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.014g/mol
Monoisotopic Mass:
209.954g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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