Phenanthrene,1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)- 5323-56-8 CAS NO.5323-56-8

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Product Details

Keywords

Phenanthrene,1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-
Phenanthrene,1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-
5323-56-8

Quick Details

ProName: Phenanthrene,1,2,3,4,4a,9,10,10a-octah...
CasNo: 5323-56-8
Molecular Formula: C19H28
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: as client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: Room Temperature
Transportation: as requested
LimitNum: 1 Gram
Heavy metal: N/A
Grade: Industrial Grade

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Details

Identification and Related Records
【Name】
Phenanthrene,1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-
【Iupac name】
1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydro-1H-phenanthrene
【CAS Registry number】
5323-56-8
【Synonyms】
Phenanthrene,1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a-dimethyl- (8CI)
Dehydroabietin
NSC 2782
Nordehydroabietane
【Molecular Formula】
C19H28 (Products with the same molecular formula)
【Molecular Weight】
256.43
【Inchi】
InChI=1/C19H28/c1-13(2)15-7-10-18-16(12-15)8-9-17-14(3)6-5-11-19(17,18)4/h7,10,12-14,17H,5-6,8-9,11H2,1-4H3
【Canonical SMILES】
CC1CCCC2(C1CCC3=C2C=CC(=C3)C(C)C)C
【MOL File】
5323-56-8.mol
Chemical and Physical Properties
【Density】
0.939 g/cm3
【Boiling Point】
339.9 °C at 760 mmHg
【Refractive Index】
1.52
【Flash Point】
157.8 °C
【Computed Properties】
Molecular Weight:256.42562 [g/mol]
Molecular Formula:C19H28
XLogP3-AA:6.7
H-Bond Donor:0
H-Bond Acceptor:0
Rotatable Bond Count:1
Exact Mass:256.219101
MonoIsotopic Mass:256.219101
Topological Polar Surface Area:0
Heavy Atom Count:19
Formal Charge:0
Complexity:318
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:3
Effective Rotor Count:2.2
Conformer Sampling RMSD:0.6
CID Conformer Count:28

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