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Home > Nitro Compounds > 74936-44-0
74936-44-0 | nitrosyl(protoporphyrin IX dimethyl ester)iron II
CAS No: 74936-44-0 Catalog No: AG00GFZL MDL No:
Product Description
Catalog Number:
AG00GFZL
Chemical Name:
nitrosyl(protoporphyrin IX dimethyl ester)iron II
CAS Number:
74936-44-0
IUPAC Name:
azanylidyneoxidanium;iron(2+);methyl 3-[8,13-bis(ethenyl)-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate
InChI:
InChI=1S/C36H36N4O4.Fe.NO/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(23)37-27;;1-2/h9-10,15-18H,1-2,11-14H2,3-8H3;;/q-2;+2;+1
InChI Key:
VQOSQBYIUPQNJK-UHFFFAOYSA-N
Properties
Complexity:
1050
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
674.207g/mol
Formal Charge:
1
Heavy Atom Count:
47
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
674.559g/mol
Monoisotopic Mass:
674.207g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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