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Home > Encyclopedia > methyl (1R,4aS,10aS)-6-bromo-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

methyl (1R,4aS,10aS)-6-bromo-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

methyl (1R,4aS,10aS)-6-bromo-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate structure

methyl (1R,4aS,10aS)-6-bromo-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate 

structure
  • CAS No:

    5335-59-1

  • Formula:

    C21H29BrO2

  • Chemical Name:

    methyl (1R,4aS,10aS)-6-bromo-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

  • Synonyms:

    NSC2964;5335-59-1;DTXSID80967980;NSC-2964;Methyl 12-bromoabieta-8(14),9(11),12-trien-18-oate;6-BROMO-1,3,4,4A,9,10,10A-OCTAHYDRO-7-ISOPROPYL-1.BETA.,4A.BETA.-DIMETHYLPHENANTHRENE-1-CARBOXYLIC ACID, METHYL ESTER

methyl (1R,4aS,10aS)-6-bromo-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate Basic Attributes

393.4 g/mol

392.13509 g/mol

2964

Characteristics

26.3 Ų

Computed Properties

Molecular Weight:393.4
XLogP3:6.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:392.13509
Monoisotopic Mass:392.13509
Topological Polar Surface Area:26.3
Heavy Atom Count:24
Complexity:490
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl (1R,4aS,10aS)-6-bromo-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

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