CAS: 22921-68-2
이름: 2-bromo-5-methoxybenzoic acid
SMILES:
COC1=CC(=C(C=C1)Br)C(=O)OMolecular Processing
Molecular formula
C8H7BrO3
Molecular weight
231.04
Exact mass
229.9579
XLogP
2.16
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
47.65
Supplementary Information
InChIKey: ODHJOROUCITYNF-UHFFFAOYSA-N
동의어
2-Bromo-5-methoxybenzoic acid22921-68-2EINECS 245-329-2DTXSID80177466RefChem:466881DTXCID9099957245-329-2Benzoic acid, 2-bromo-5-methoxy-MFCD000202145-Methoxy-2-bromobenzoic acid2-bromo-5-methoxy-benzoic acid6-Bromo-m-anisic acid2-Bromo-5-methoxybenzoicacid6-Bromo-m-anisic Acid; 2-Bromo-5-(methyloxy)benzoic acid; 2-Bromo-5-methoxybenzoic acid;SCHEMBL2272382-bromo-5-methoxy benzoic acid2-bromo-5-(methyloxy)benzoic acidALBB-037314STR03486CL8029SBB0633352-Bromo-5-methoxybenzoic acid, 98%AKOS000120615AC-2588CS-W012953EBC-152250FB70043FS-3346SY002265DB-002044
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