200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89822-04-8
89822-04-8 | 1,2-Cyclohexanediol, 4-[1-(hydroxymethyl)ethenyl]-1-methyl-
CAS No: 89822-04-8 Catalog No: AG003Z62 MDL No:
Product Description
Catalog Number:
AG003Z62
Chemical Name:
1,2-Cyclohexanediol, 4-[1-(hydroxymethyl)ethenyl]-1-methyl-
CAS Number:
89822-04-8
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
IUPAC Name:
4-(3-hydroxyprop-1-en-2-yl)-1-methylcyclohexane-1,2-diol
InChI:
InChI=1S/C10H18O3/c1-7(6-11)8-3-4-10(2,13)9(12)5-8/h8-9,11-13H,1,3-6H2,2H3
InChI Key:
NMYWRSLDBHPLDF-UHFFFAOYSA-N
SMILES:
OCC(=C)C1CCC(C(C1)O)(C)O
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.