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Home > Nitro Compounds > 827325-29-1
827325-29-1 | Benzoyl chloride, 2,4-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-5-nitro-
CAS No: 827325-29-1 Catalog No: AG004ZVU MDL No:
Product Description
Catalog Number:
AG004ZVU
Chemical Name:
Benzoyl chloride, 2,4-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-5-nitro-
CAS Number:
827325-29-1
Molecular Formula:
C21H32ClNO11
Molecular Weight:
509.9319
IUPAC Name:
2,4-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-5-nitrobenzoyl chloride
InChI:
InChI=1S/C21H32ClNO11/c1-27-3-5-29-7-9-31-11-13-33-19-16-20(18(23(25)26)15-17(19)21(22)24)34-14-12-32-10-8-30-6-4-28-2/h15-16H,3-14H2,1-2H3
InChI Key:
PBYVBVBRWGPKNJ-UHFFFAOYSA-N
SMILES:
COCCOCCOCCOc1cc(OCCOCCOCCOC)c(cc1[N+](=O)[O-])C(=O)Cl
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
509.166g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
509.933g/mol
Monoisotopic Mass:
509.166g/mol
Rotatable Bond Count:
21
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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