 Home > Encyclopedia > (1R,4aS,10aR)-6-acetyl-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonitrile

(1R,4aS,10aR)-6-acetyl-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonitrile

(1R,4aS,10aR)-6-acetyl-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonitrile structure

CAS No:
5335-58-0
Formula:
C22H29NO
Chemical Name:
(1R,4aS,10aR)-6-acetyl-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonitrile
Synonyms:
5335-58-0;ND 8774;ND-8774;NSC2963;NSC146204;1-Phenanthrenecarbonitrile, 6-acetyl-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)-;NSC 2963;NSC 146204;DTXSID00201510;NSC-2963;ZINC4403830;NSC-146204;(1R,4aS,10aR)-6-acetyl-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonitrile;6-ACETYL-1.ALPHA.-CYANO-1,3,4,4A,9,10,10A-OCTAHYDRO-7-ISOPROPYL-1.BETA.,4A.BETA.-DIMETHYLPHENANTHRENE

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(1R,4aS,10aR)-6-acetyl-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonitrile Basic Attributes

Molecular Weight：

323.5 g/mol

Exact Mass：

323.224914549 g/mol

NSC Number：

146204|2963

DSSTox ID：

DTXSID00201510

Characteristics

PSA：

40.9 Å²

Computed Properties

Molecular Weight:323.5
XLogP3:5.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:323.224914549
Monoisotopic Mass:323.224914549
Topological Polar Surface Area:40.9
Heavy Atom Count:24
Complexity:558
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: sodium stearate; thiophene; ankle dislocation; formula carbon disulfide; cl2o7; hexene

Guide of (1R,4aS,10aR)-6-acetyl-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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