200,000+ products from a single source!
sales@angenechem.com
7715-72-2 | 1-Phenanthrenecarboxylicacid, 7-ethyltetradecahydro-1,4a,7-trimethyl-, (1R,4aR,4bS,7R,8aS,10aR)-
CAS No: 7715-72-2 Catalog No: AG0055HY MDL No:
Product Description
Catalog Number:
AG0055HY
Chemical Name:
1-Phenanthrenecarboxylicacid, 7-ethyltetradecahydro-1,4a,7-trimethyl-, (1R,4aR,4bS,7R,8aS,10aR)-
CAS Number:
7715-72-2
Molecular Formula:
C20H34O2
Molecular Weight:
306.4828
IUPAC Name:
(1R,4aR,4bS,7R,8aS,10aR)-7-ethyl-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid
InChI:
InChI=1S/C20H34O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h14-16H,5-13H2,1-4H3,(H,21,22)/t14-,15-,16+,18+,19+,20+/m0/s1
InChI Key:
UPTDGYZWMBPKCL-MYOQPVCSSA-N
SMILES:
CC[C@]1(C)CC[C@H]2[C@H](C1)CC[C@@H]1[C@]2(C)CCC[C@@]1(C)C(=O)O
Properties
Complexity:
459
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
6
Defined Bond Stereocenter Count:
0
Exact Mass:
306.256g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.49g/mol
Monoisotopic Mass:
306.256g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^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.