CAS: 232275-49-9
이름: methyl 4-amino-2,6-dichlorobenzoate
SMILES:
COC(=O)C1=C(C=C(C=C1Cl)N)ClMolecular Processing
Molecular formula
C8H7Cl2NO2
Molecular weight
220.05
Exact mass
218.9854
XLogP
2.36
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
52.21
Supplementary Information
InChIKey: KBMZQFQCPXVGJR-UHFFFAOYSA-N
동의어
Methyl 4-amino-2,6-dichlorobenzoate232275-49-9Methyl 2,6-dichloro-4-aminobenzoate4-Amino-2,6-dichloro-benzoic acid methyl esterBenzoic acid, 4-amino-2,6-dichloro-, methyl esterMFCD224934084-Amino-2,6-dichlorobenzoic acid methyl esterSCHEMBL1707046KBMZQFQCPXVGJR-UHFFFAOYSA-NDTXSID501233190HJA27549Methyl4-amino-2,6-dichlorobenzoateSB35753DB-1177822,6-dichloro-4-aminobenzoic acid methyl esterEN300-2008356
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