CAS: 136818-66-1
이름: methyl 6-nitro-1H-indole-2-carboxylate
SMILES:
COC(=O)C1=CC2=C(N1)C=C(C=C2)[N+](=O)[O-]Molecular Processing
Molecular formula
C10H8N2O4
Molecular weight
220.18
Exact mass
220.0484
XLogP
1.86
TPSA
85.23
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
56.29
Supplementary Information
InChIKey: XYESWWUBKWDGNI-UHFFFAOYSA-N
동의어
Methyl 6-nitro-1H-indole-2-carboxylate136818-66-1MFCD07357550methyl 6-nitroindole-2-carboxylate6-Nitro-1H-indole-2-carboxylic acid methyl esterSCHEMBL3029155DTXSID90473542XYESWWUBKWDGNI-UHFFFAOYSA-NSTK019223AKOS005144378SY007837CS-0188105E75866F231083
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