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1892-12-2 | Cyclododecanemethanol
CAS No: 1892-12-2 Catalog No: AG002I1U MDL No:MFCD00003719
Product Description
Catalog Number:
AG002I1U
Chemical Name:
Cyclododecanemethanol
CAS Number:
1892-12-2
Molecular Formula:
C13H26O
Molecular Weight:
198.3449
MDL Number:
MFCD00003719
IUPAC Name:
cyclododecylmethanol
InChI:
InChI=1S/C13H26O/c14-12-13-10-8-6-4-2-1-3-5-7-9-11-13/h13-14H,1-12H2
InChI Key:
JQYWAZNRRQRPNN-UHFFFAOYSA-N
SMILES:
OCC1CCCCCCCCCCC1
EC Number:
217-574-5
NSC Number:
100761
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.198g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.35g/mol
Monoisotopic Mass:
198.198g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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