Cas no 29790-47-4 (1,4-Naphthalenedione,2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]-)
![1,4-Naphthalenedione,2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]- structure](https://ossimg.kuujia.com/scimg/30000/29790-47-4x500.png)
29790-47-4 structure
Product Name:1,4-Naphthalenedione,2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]-
CAS No:29790-47-4
MF:C50H70O2
MW:703.089615345001
CID:270788
PubChem ID:5376004
Update Time:2025-04-19
1,4-Naphthalenedione,2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Naphthalenedione,2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]-
- 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl]naphthalene-1,4-dione
- 29790-47-4
- 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]naphthalene-1,4-dione
- 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-Octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaenyl]naphthoquinone #
- (all-E)-2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaenyl)-1,4-naphthalenedione
- 1,4-Naphthoquinone, 2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaenyl)-
- Menaquinone 8, demethyl-
- Q27121213
- LMPR02030027
- CHEBI:48455
- 2-demethylmenaquinone-8
- demethylmenaquinone
- DTXSID601314836
- SCHEMBL2477602
- GDUBPWSFXUAETN-AENDIINCSA-N
- 1,4-Naphthalenedione, 2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaenyl)-
- 1,4-Naphthalenedione, 2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaenyl)-, (all-E)-
- Demethylmenaquinone 8
-
- Inchi： 1S/C50H70O2/c1-38(2)19-12-20-39(3)21-13-22-40(4)23-14-24-41(5)25-15-26-42(6)27-16-28-43(7)29-17-30-44(8)31-18-32-45(9)35-36-46-37-49(51)47-33-10-11-34-48(47)50(46)52/h10-11,19,21,23,25,27,29,31,33-35,37H,12-18,20,22,24,26,28,30,32,36H2,1-9H3/b39-21+,40-23+,41-25+,42-27+,43-29+,44-31+,45-35+
- InChI Key： GDUBPWSFXUAETN-AENDIINCSA-N
- SMILES： O=C1C2C=CC=CC=2C(C=C1C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)=O
Computed Properties
- Exact Mass: 702.537581
- Monoisotopic Mass: 702.537581
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 52
- Rotatable Bond Count: 23
- Complexity: 1420
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 7
- Undefined Bond Stereocenter Count: 0
- XLogP3: 16.8
- Topological Polar Surface Area: 34.1
Experimental Properties
- Density: 0.959
- Boiling Point: 757.7°Cat760mmHg
- Flash Point: 266°C
1,4-Naphthalenedione,2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]- Related Literature
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Javad Zamani Amirzakaria,Sayed-Amir Marashi,Mohammad Ali Malboobi,Tahmineh Lohrasebi,Esmail Forouzan Mol. Omics 2022 18 328
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