Home Other Building Blocks (1S,2S)-N,N'-Bis(2-acetyl-3-oxo-2-butenylidene)-1,2-dimesitylethylenediaminato cobalt(II)

(1S,2S)-N,N'-Bis(2-acetyl-3-oxo-2-butenylidene)-1,2-dimesitylethylenediaminato cobalt(II)

CAS No.:
259259-80-8
Catalog Number:
AG002R36
Molecular Formula:
C32H38CoN2O4
Molecular Weight:
573.5883
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
1 week
United States
$455
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Product Description
Catalog Number:
AG002R36
Chemical Name:
(1S,2S)-N,N'-Bis(2-acetyl-3-oxo-2-butenylidene)-1,2-dimesitylethylenediaminato cobalt(II)
CAS Number:
259259-80-8
Molecular Formula:
C32H38CoN2O4
Molecular Weight:
573.5883
MDL Number:
MFCD06797062
IUPAC Name:
(E)-3-[[(1S,2S)-2-[[(E)-2-acetyl-3-hydroxybut-2-enylidene]amino]-1,2-bis(2,4,6-trimethylphenyl)ethyl]iminomethyl]-4-hydroxypent-3-en-2-one;cobalt
InChI:
InChI=1S/C32H40N2O4.Co/c1-17-11-19(3)29(20(4)12-17)31(33-15-27(23(7)35)24(8)36)32(34-16-28(25(9)37)26(10)38)30-21(5)13-18(2)14-22(30)6;/h11-16,31-32,35,37H,1-10H3;/b27-23+,28-25+,33-15?,34-16?;/t31-,32-;/m0./s1
InChI Key:
YQMKZEIIMHVFTI-VURWZECESA-N
SMILES:
Cc1cc(C)c(c(c1)C)[C@@H]([C@H](c1c(C)cc(cc1C)C)/N=C/C(=C(/C)\[O-])/C(=O)C)/N=C/C(=C(/C)\[O-])/C(=O)C.[Co+2]
Properties
Complexity:
883  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
2  
Exact Mass:
575.232g/mol
Formal Charge:
0
Heavy Atom Count:
39  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
575.615g/mol
Monoisotopic Mass:
575.232g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
99.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties