200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 887511-38-8
887511-38-8 | 1,3-Dithiole-4-methanol, 2-[4,5-bis(pentylthio)-1,3-dithiol-2-ylidene]-
CAS No: 887511-38-8 Catalog No: AG004DCM MDL No:
Product Description
Catalog Number:
AG004DCM
Chemical Name:
1,3-Dithiole-4-methanol, 2-[4,5-bis(pentylthio)-1,3-dithiol-2-ylidene]-
CAS Number:
887511-38-8
Molecular Formula:
C17H26OS6
Molecular Weight:
438.7777
IUPAC Name:
[2-[4,5-bis(pentylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]methanol
InChI:
InChI=1S/C17H26OS6/c1-3-5-7-9-19-14-15(20-10-8-6-4-2)24-17(23-14)16-21-12-13(11-18)22-16/h12,18H,3-11H2,1-2H3
InChI Key:
CHLZLXZHVWPQHR-UHFFFAOYSA-N
SMILES:
CCCCCSC1=C(SCCCCC)SC(=C2SC=C(S2)CO)S1
Properties
Complexity:
471
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.031g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
438.754g/mol
Monoisotopic Mass:
438.031g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
172A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.