Home Other Building Blocks 3,6-Dimethyl-3,6-octanediol, () + meso, 97%

3,6-Dimethyl-3,6-octanediol, () + meso, 97%

CAS No.:
78-65-9
Catalog Number:
AG003IQP
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003IQP
Chemical Name:
3,6-Dimethyl-3,6-octanediol, () + meso, 97%
CAS Number:
78-65-9
MDL Number:
MFCD00021827
IUPAC Name:
3,6-dimethyloctane-3,6-diol
InChI:
InChI=1S/C10H22O2/c1-5-9(3,11)7-8-10(4,12)6-2/h11-12H,5-8H2,1-4H3
InChI Key:
WMEDSSFYIKNTNG-UHFFFAOYSA-N
EC Number:
201-130-2
NSC Number:
5614
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.162g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
174.284g/mol
Monoisotopic Mass:
174.162g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties