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Hdmc

CAS No.:
1082951-62-9
Catalog Number:
AG008R59
Molecular Formula:
C13H26ClF6N5O2P
Molecular Weight:
464.7950
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$38
- +
25g
98%
In Stock USA
United States
$157
- +
100g
98%
In Stock USA
United States
$594
- +
Product Description
Catalog Number:
AG008R59
Chemical Name:
Hdmc
CAS Number:
1082951-62-9
Molecular Formula:
C13H26ClF6N5O2P
Molecular Weight:
464.7950
MDL Number:
MFCD16875663
IUPAC Name:
[(5-chloro-3-oxidobenzotriazol-3-ium-1-yl)-morpholin-4-ylmethylidene]-dimethylazanium;hexafluorophosphate
InChI:
InChI=1S/C13H17ClN5O2.F6P/c1-16(2)13(17-5-7-21-8-6-17)18-11-4-3-10(14)9-12(11)19(20)15-18;1-7(2,3,4,5)6/h3-4,9H,5-8H2,1-2H3;/q+1;-1
InChI Key:
MGRTWUAUKJMOER-UHFFFAOYSA-N
SMILES:
FP(F)(F)(F)F.Clc1ccc2c(c1)n(O)nn2C(=[N](C)C)N1CCOCC1.F
Properties
Complexity:
474  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
455.071g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
455.726g/mol
Monoisotopic Mass:
455.071g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties