Min.Order / FOB Price:Get Latest Price
1 Gram |
Negotiable |
N,N-bis(1,2,3,4-tetrahydrophenanthren-9-ylmethyl)ethane-1,2-diamine 5431-87-8 98%
【Name】
N,N'-bis(1,2,3,4-tetrahydrophenanthren-9-ylmethyl)ethane-1,2-diamine
【CAS Registry number】
5431-87-8
【Synonyms】
n,n'
-bis(1,2,3,4-tetrahydrophenanthren-9-ylmethyl)ethane-1,2-diamine
NSC13649
AC1L5DKZ
AC1Q2ASM
AR-1K1105
NSC-13649
【Molecular Formula】
C32H36N2 (Products with the same molecular formula)
【Molecular Weight】
448.6416
【Inchi】
InChI=1/C32H36N2/c1-3-11-27-23(9-1)19-25(29-13-5-7-15-31(27)29)21-33-17-18-34-22-26-20-24-10-2-4-12-28(24)32-16-8-6-14-30(26)32/h5-8,13-16,19-20,33-34H,1-4,9-12,17-18,21-22H2
【Canonical SMILES】
C1CCC2=C(C1)C=C(C3=CC=CC=C23)CNCCNCC4=CC5=C(CCCC5)C6=CC=CC=C64
【MOL File】
5431-87-8.mol
Chemical and Physical Properties
【Density】
1.134g/cm3
【Boiling Point】
658.6°C at 760 mmHg
【Refractive Index】
1.66
【Flash Point】
411.5°C
【Computed Properties】
Molecular Weight:448.64164 [g/mol]
Molecular Formula:C32H36N2
XLogP3-AA:7.6
H-Bond Donor:2
H-Bond Acceptor:2
Rotatable Bond Count:7
Exact Mass:448.287849
MonoIsotopic Mass:448.287849
Topological Polar Surface Area:24.1
Heavy Atom Count:34
Formal Charge:0
Complexity:579
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Donor Count:2
Feature 3D Cation Count:2
Feature 3D Ring Count:6
Effective Rotor Count:8.6
Conformer Sampling RMSD:1
CID Conformer Count:139
CAS NO:29911-28-2
CAS NO:32435-46-4
CAS NO:9046-10-0
CAS NO:307297-39-8
CAS NO:114435-02-8
CAS NO:10497-05-9
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View