200,000+ products from a single source!
sales@angenechem.com
89195-29-9 | Cholestane, 2,3-dibromo-
CAS No: 89195-29-9 Catalog No: AG003VML MDL No:
Product Description
Catalog Number:
AG003VML
Chemical Name:
Cholestane, 2,3-dibromo-
CAS Number:
89195-29-9
Molecular Formula:
C27H46Br2
Molecular Weight:
530.4621
IUPAC Name:
2,3-dibromo-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
InChI:
InChI=1S/C27H46Br2/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-24(28)25(29)16-27(19,5)23(20)13-14-26(21,22)4/h17-25H,6-16H2,1-5H3
InChI Key:
KFRQNXHOVDCRIV-UHFFFAOYSA-N
SMILES:
CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2[C@]1(C)CC(Br)C(C2)Br)C)C
Properties
Complexity:
573
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
530.195g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
530.473g/mol
Monoisotopic Mass:
528.197g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
10
Undefined Bond Stereocenter Count:
0
XLogP3:
11.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.