200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 85392-33-2
85392-33-2 | Bicyclo[4.1.0]heptan-3-ol,4,4'-thiobis[3,7,7-trimethyl-
CAS No: 85392-33-2 Catalog No: AG004TMC MDL No:
Product Description
Catalog Number:
AG004TMC
Chemical Name:
Bicyclo[4.1.0]heptan-3-ol,4,4'-thiobis[3,7,7-trimethyl-
CAS Number:
85392-33-2
Molecular Formula:
C20H34O2S
Molecular Weight:
338.5478
IUPAC Name:
4-[(4-hydroxy-4,7,7-trimethyl-3-bicyclo[4.1.0]heptanyl)sulfanyl]-3,7,7-trimethylbicyclo[4.1.0]heptan-3-ol
InChI:
InChI=1S/C20H34O2S/c1-17(2)11-7-15(19(5,21)9-13(11)17)23-16-8-12-14(18(12,3)4)10-20(16,6)22/h11-16,21-22H,7-10H2,1-6H3
InChI Key:
VTOLOYGWYKBTJJ-UHFFFAOYSA-N
SMILES:
CC1(O)CC2C(CC1SC1CC3C(CC1(C)O)C3(C)C)C2(C)C
EC Number:
286-891-9
NSC Number:
655930
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.228g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
338.55g/mol
Monoisotopic Mass:
338.228g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
8
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
© 2019 Angene International Limited. All rights Reserved.