CAS: 774-81-2
이름: 2-(3-bromo-4-methoxyphenyl)acetic acid
SMILES:
COC1=C(C=C(C=C1)CC(=O)O)BrMolecular Processing
Molecular formula
C9H9BrO3
Molecular weight
245.07
Exact mass
243.9735
XLogP
2.08
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
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
0.222
Molar refractivity
52.03
Supplementary Information
InChIKey: POTVGQUUEQTPNA-UHFFFAOYSA-N
동의어
3-Bromo-4-methoxyphenylacetic acid774-81-22-(3-bromo-4-methoxyphenyl)acetic acidDTXSID10228112RefChem:498683DTXCID30150603635-818-2(3-bromo-4-methoxyphenyl)acetic acidMFCD00017538(3-bromo-4-methoxy-phenyl)-acetic acidBenzeneacetic acid, 3-bromo-4-methoxy-2-(3-bromo-4-methoxy-phenyl)acetic acidSCHEMBL1384493-bromo-4-meth-oxyphenylacetic acid3-Bromo-4-methoxyphenylacetic acid?BBL027842SBB017829AKOS002268767AC-2813FB33575FS-2535SY003029[3-bromo-4-(methyloxy)phenyl]acetic acid2-(3-bromo-4-methoxy-phenyl) acetic acidDB-022348B4677CS-0037013ST50169430EN300-84160F112400
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