CAS: 641-70-3
الاسم: 4-nitro-2-benzofuran-1,3-dione
SMILES:
C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)OC2=OMolecular Processing
Molecular formula
C8H3NO5
Molecular weight
193.11
Exact mass
193.0011
XLogP
0.91
TPSA
86.51
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
42.84
Supplementary Information
InChIKey: ROFZMKDROVBLNY-UHFFFAOYSA-N
مرادفات
3-Nitrophthalic anhydride641-70-3Phthalic anhydride, 3-nitro-1,3-Isobenzofurandione, 4-nitro-X2BXS9KCY2NSC-4134NSC-27006DTXSID0060939RefChem:95047DTXCID7044213211-373-64-Nitro-2-benzofuran-1,3-dione4-nitroisobenzofuran-1,3-dioneMFCD000059214-nitro-isobenzofuran-1,3-dione3-Nitrophthalicanhydride3-nitro phthalic anhydride1,3-Isobenzofurandione, nitro-NSC 4134EINECS 211-373-6NSC 27006nitrophthalic anhydride4-NITRO-1,3-ISOBENZOFURANDIONEAI3-03720UNII-X2BXS9KCY23-nitro-phtalic anhydride4-nitro-1,3-dihydro-2-benzofuran-1,3-dioneSCHEMBL772523-nitrophtalic acid anhydride25639-55-8
مشارك في 126 تفاعل→