CN1C=CC2=C1C=CC(=C2)Cl
CAS: 112398-75-1
Название: 5-chloro-1-methylindole
SMILES: CN1C=CC2=C1C=CC(=C2)Cl

Molecular Processing

Molecular formula
C9H8ClN
Molecular weight
165.62
Exact mass
165.0345
XLogP
2.83
TPSA
4.93
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
47.93

Supplementary Information

InChIKey: UAUJZFNYIBXEDG-UHFFFAOYSA-N
Синонимы
5-Chloro-1-methylindole112398-75-1DTXSID30445985RefChem:302227DTXCID703968065-chloro-1-methyl-1H-indoleMFCD110448481H-Indole, 5-chloro-1-methyl-5-chloro-1-methyl-indole1-methyl-5-chloroindoleSCHEMBL1092086SCHEMBL1092569SCHEMBL7386654UAUJZFNYIBXEDG-UHFFFAOYSA-NAKOS006307604BS-26048SY243350DB-060206A10102
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