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3045-76-9

3045-76-9 | Cyclododecanone, 2-methylene-

CAS No: 3045-76-9 Catalog No: AG00306F MDL No:

Product Description

Catalog Number:
AG00306F
Chemical Name:
Cyclododecanone, 2-methylene-
CAS Number:
3045-76-9
Molecular Formula:
C13H22O
Molecular Weight:
194.3132
IUPAC Name:
2-methylidenecyclododecan-1-one
InChI:
InChI=1S/C13H22O/c1-12-10-8-6-4-2-3-5-7-9-11-13(12)14/h1-11H2
InChI Key:
YXRHKQPDROMYDX-UHFFFAOYSA-N
SMILES:
O=C1CCCCCCCCCCC1=C

Properties

Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.167g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.318g/mol
Monoisotopic Mass:
194.167g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  

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