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827302-77-2 | 2-Decyne, 4-bromo-
CAS No: 827302-77-2 Catalog No: AG0050SK MDL No:
Product Description
Catalog Number:
AG0050SK
Chemical Name:
2-Decyne, 4-bromo-
CAS Number:
827302-77-2
Molecular Formula:
C10H17Br
Molecular Weight:
217.1460
IUPAC Name:
4-bromodec-2-yne
InChI:
InChI=1S/C10H17Br/c1-3-5-6-7-9-10(11)8-4-2/h10H,3,5-7,9H2,1-2H3
InChI Key:
HOESPTNUCRFIPB-UHFFFAOYSA-N
SMILES:
CCCCCCC(C#CC)Br
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.051g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.15g/mol
Monoisotopic Mass:
216.051g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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