200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 262355-96-4
262355-96-4 | 2(3H)-Phenanthrenone, 4,4a,4b,5,6,7,8,8a,9,10-decahydro-10-hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-, (4aR,4bS,8R,8aR,10R)-
CAS No: 262355-96-4 Catalog No: AG002SEP MDL No:MFCD20260895
Product Description
Catalog Number:
AG002SEP
Chemical Name:
2(3H)-Phenanthrenone, 4,4a,4b,5,6,7,8,8a,9,10-decahydro-10-hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-, (4aR,4bS,8R,8aR,10R)-
CAS Number:
262355-96-4
Molecular Formula:
C17H26O3
Molecular Weight:
278.3865
MDL Number:
MFCD20260895
IUPAC Name:
(4aR,4bS,8S)-10-hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-one
InChI:
InChI=1S/C17H26O3/c1-16(10-18)6-3-7-17(2)13-5-4-11(19)8-12(13)14(20)9-15(16)17/h8,13-15,18,20H,3-7,9-10H2,1-2H3/t13-,14?,15?,16+,17+/m0/s1
InChI Key:
ZAYXCFZRTAJXMC-LMCYLSQRSA-N
SMILES:
OC[C@]1(C)CCC[C@]2([C@H]1C[C@@H](O)C1=CC(=O)CC[C@H]21)C
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
278.188g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
278.392g/mol
Monoisotopic Mass:
278.188g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.