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Home > Pyridines > 648431-98-5
648431-98-5 | Pyridine, 3-(1,3-butadiynyl)- (9CI)
CAS No: 648431-98-5 Catalog No: AG00F9G0 MDL No:
Product Description
Catalog Number:
AG00F9G0
Chemical Name:
Pyridine, 3-(1,3-butadiynyl)- (9CI)
CAS Number:
648431-98-5
IUPAC Name:
3-buta-1,3-diynylpyridine
InChI:
InChI=1S/C9H5N/c1-2-3-5-9-6-4-7-10-8-9/h1,4,6-8H
InChI Key:
MQDIEZLSNHQGRV-UHFFFAOYSA-N
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.042g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.146g/mol
Monoisotopic Mass:
127.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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