METHYL DEHYDROABIETATE

methyl (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

CAS: 1235-74-1

Molecular Formula	`C21H30O2`
Molecular Weight	314.5 g/mol
LogP	5.9
Topological Polar Surface Area	26.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	3
Exact Mass	314.22458
Heavy Atoms	23
Complexity	457.0

Chemical Identifiers

CAS Number	1235-74-1
SMILES	`CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)OC)C`
InChIKey	`PGZCJOPTDHWYES-HMXCVIKNSA-N`

📖 Product Overview

METHYL DEHYDROABIETATE (CAS: 1235-74-1) is a chemical compound with molecular formula C21H30O2 and molecular weight 314.5 g/mol. Its IUPAC systematic name is methyl (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate. LogP 5.9 Topological Polar Surface Area 26.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 3 Exact Mass 314.22458 Heavy Atoms 23 Complexity 457.0 InChI Key: PGZCJOPTDHWYES-HMXCVIKNSA-N. SMILES: CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)OC)C.

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