CAS: 7206-70-4
이름: 4-amino-5-chloro-2-methoxybenzoic acid
SMILES:
COC1=CC(=C(C=C1C(=O)O)Cl)NMolecular Processing
Molecular formula
C8H8ClNO3
Molecular weight
201.61
Exact mass
201.0193
XLogP
1.63
TPSA
72.55
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
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
49.38
Supplementary Information
InChIKey: RVEATKYEARPWRE-UHFFFAOYSA-N
동의어
4-Amino-5-chloro-2-methoxybenzoic acid7206-70-44-Amino-5-chloro-o-anisic acidBenzoic acid, 4-amino-5-chloro-2-methoxy-2-methoxy-4-amino-5-chlorobenzoic acidPQ8L2L84ELEINECS 230-582-35-Chloro-4-amino-2-methoxybenzoic acid5-CHLORO-4-AMINO-2-ETHOXYBENZOIC ACIDDTXSID502223914-amino-5-chloro-3-methoxybenzoic acidO-ANISIC ACID, 4-AMINO-5-CHLORO-4-amino-5-chloro-2-(methyloxy)benzoic acidMETOCLOPRAMIDE IMPURITY C [EP IMPURITY]METOCLOPRAMIDE IMPURITY C (EP IMPURITY)RefChem:517932DTXCID50144882230-582-3MFCD00038794Metoclopramide EP Impurity CMetocloprCmide EP Impurity C2-methoxy-4-amino-5-chloro benzoic acid4-Amino-5-chloro-2-methoxy-benzoic acidMetoclopramide Impurity CUNII-PQ8L2L84EL4-AMINO-5-CHLORO-2-METHOXYBENZOICACID4-Amino-5-chloro-2-methoxybenzoic Acid; Metoclopramide Imp. C (EP); Metoclopramide Hydrochloride Monohydrate Impurity C; Metoclopramide Impurity C; Metoclopramide Impurity CTimTec1_000243Oprea1_036404SCHEMBL99019
248개 반응에 참여→