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43001-25-8 | 4-Iodo-1-butyne
CAS No: 43001-25-8 Catalog No: AG003LK3 MDL No:MFCD20414835
Product Description
Catalog Number:
AG003LK3
Chemical Name:
4-Iodo-1-butyne
CAS Number:
43001-25-8
Molecular Formula:
C4H5I
Molecular Weight:
179.9870
MDL Number:
MFCD20414835
IUPAC Name:
4-iodobut-1-yne
InChI:
InChI=1S/C4H5I/c1-2-3-4-5/h1H,3-4H2
InChI Key:
SGLSTFIXVDSVNV-UHFFFAOYSA-N
SMILES:
ICCC#C
Properties
Complexity:
47.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.944g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.988g/mol
Monoisotopic Mass:
179.944g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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