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20799-98-8 | 1,2-Ethanediamine, N2-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)-N1,N1-dimethyl-, hydrochloride (1:2)
CAS No: 20799-98-8 Catalog No: AG002JF4 MDL No:
Product Description
Catalog Number:
AG002JF4
Chemical Name:
1,2-Ethanediamine, N2-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)-N1,N1-dimethyl-, hydrochloride (1:2)
CAS Number:
20799-98-8
Molecular Formula:
C19H26Cl2N2
Molecular Weight:
353.3291
IUPAC Name:
N',N'-dimethyl-N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)ethane-1,2-diamine
InChI:
InChI=1S/C19H24N2/c1-21(2)14-13-20-19-17-9-5-3-7-15(17)11-12-16-8-4-6-10-18(16)19/h3-10,19-20H,11-14H2,1-2H3
InChI Key:
CZULGHYJEDZFMY-UHFFFAOYSA-N
SMILES:
CN(CCNC1c2ccccc2CCc2c1cccc2)C.Cl.Cl
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.194g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.415g/mol
Monoisotopic Mass:
280.194g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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