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Home > Other Building Blocks > 115254-98-3
115254-98-3 | 10,12-Docosadiyne
CAS No: 115254-98-3 Catalog No: AG000GJB MDL No:
Product Description
Catalog Number:
AG000GJB
Chemical Name:
10,12-Docosadiyne
CAS Number:
115254-98-3
Molecular Formula:
C22H38
Molecular Weight:
302.5371
IUPAC Name:
docosa-10,12-diyne
InChI:
InChI=1S/C22H38/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-18H2,1-2H3
InChI Key:
RDIWETBQCKTRSO-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC#CC#CCCCCCCCCC
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.297g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.546g/mol
Monoisotopic Mass:
302.297g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.3
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