CAS: 10517-21-2
이름: 5-chloro-1H-indole-2-carboxylic acid
SMILES:
C1=CC2=C(C=C1Cl)C=C(N2)C(=O)OMolecular Processing
Molecular formula
C9H6ClNO2
Molecular weight
195.6
Exact mass
195.0087
XLogP
2.52
TPSA
53.09
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
50.27
Supplementary Information
InChIKey: FUQOTYRCMBZFOL-UHFFFAOYSA-N
동의어
5-Chloroindole-2-carboxylic acid10517-21-25-Chloro-1H-indole-2-carboxylic acid5-Chloroindole-2-carboxylate1H-Indole-2-carboxylic acid, 5-chloro-NSC-75651HZ63WGR8YYDTXSID60146993RefChem:534965DTXCID8069484234-050-1MFCD00005613Spectrum_000183EINECS 234-050-1BRN 01532295-Chloro-1H-indole-2-carboxylic Acid; 2-Carboxy-5-chloroindole; NSC 75651SpecPlus_000670Spectrum2_000513Spectrum3_000783Spectrum4_001044Spectrum5_001833Biomol-NT_0001982-Carboxy-5-chloro-indoleNCIOpen2_0008935-chloroindolecarboxylic acidOprea1_643267BSPBio_002486KBioGR_001308KBioSS_000663MLS002207052
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