200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 19781-27-2
19781-27-2 | 3-Octanol, 6-ethyl-
CAS No: 19781-27-2 Catalog No: AG002B2Q MDL No:
Product Description
Catalog Number:
AG002B2Q
Chemical Name:
3-Octanol, 6-ethyl-
CAS Number:
19781-27-2
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
IUPAC Name:
6-ethyloctan-3-ol
InChI:
InChI=1S/C10H22O/c1-4-9(5-2)7-8-10(11)6-3/h9-11H,4-8H2,1-3H3
InChI Key:
JWZFCOOWAQHCBP-UHFFFAOYSA-N
SMILES:
CCC(CCC(CC)CC)O
NSC Number:
92785
Properties
Complexity:
76.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.167g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.285g/mol
Monoisotopic Mass:
158.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.