3-NITRO-2-NAPHTHOIC ACID, MAGNESIUM SALT-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT

CAS No.
83877-99-0
CCD No.
CCD08021086
Formula
C42 H12 Cl24 Mg N2 O8
MolWeight
1547.74

Basic Information

Product Name: 3-NITRO-2-NAPHTHOIC ACID, MAGNESIUM SALT-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT
CAS: 83877-99-0
English Synonyms: 3-NITRO-2-NAPHTHOIC ACID, MAGNESIUM SALT-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT
MDL Number.: MFCD00135893
H bond acceptor: 10
H bond donor: 0
Smile: c1c2c(cc(c1C(=O)O[Mg]OC(=O)c3cc4c(cc3[N+](=O)[O-])C5C(C6C4[C@@]7(C(=C([C@]6(C7(Cl)Cl)Cl)Cl)Cl)Cl)[C@@]8(C(=C([C@]5(C8(Cl)Cl)Cl)Cl)Cl)Cl)[N+](=O)[O-])C9C(C1C2[C@]2(C(=C([C@@]1(C2(Cl)Cl)Cl)Cl)Cl)Cl)[C@]1(C(=C([C@@]9(C1(Cl)Cl)Cl)Cl)Cl)Cl
InChi: InChI=1S/2C21H7Cl12NO4.Mg/c2*22-11-13(24)18(28)9-7(16(11,26)20(18,30)31)3-1-5(15(35)36)6(34(37)38)2-4(3)8-10(9)19(29)14(25)12(23)17(8,27)21(19,32)33;/h2*1-2,7-10H,(H,35,36);/q;;+2/p-2/t2*7?,8?,9?,10?,16-,17+,18+,19-;/m10./s1
InChiKey: InChIKey=ULAGDSKEGOQEPP-SNENDFAQSA-L

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