methyl (1S,4aS)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

CAS: 3650-04-2

Molecular Formula	`C18H24O2`
Molecular Weight	272.4 g/mol
LogP	4.8
Topological Polar Surface Area	26.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	2
Exact Mass	272.17764
Heavy Atoms	20
Complexity	391.0

Chemical Identifiers

CAS Number	3650-04-2
SMILES	`CC12CCCC(C1CCC3=CC=CC=C23)(C)C(=O)OC`
InChIKey	`ZOUKXUZJBJOWQH-KVJCIMDZSA-N`

📖 Product Overview

methyl (1S,4aS)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate (CAS: 3650-04-2) is a chemical compound with molecular formula C18H24O2 and molecular weight 272.4 g/mol. Its IUPAC systematic name is methyl (1S,4aS)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate. LogP 4.8 Topological Polar Surface Area 26.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 2 Exact Mass 272.17764 Heavy Atoms 20 Complexity 391.0 InChI Key: ZOUKXUZJBJOWQH-KVJCIMDZSA-N. SMILES: CC12CCCC(C1CCC3=CC=CC=C23)(C)C(=O)OC.

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