COC1=C(C=C(C=C1)Cl)C(=O)O
CAS: 3438-16-2
Name: 5-chloro-2-methoxybenzoic acid
SMILES: COC1=C(C=C(C=C1)Cl)C(=O)O

Molecular Processing

Molecular formula
C8H7ClO3
Molecular weight
186.59
Exact mass
186.0084
XLogP
2.05
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
44.96

Supplementary Information

InChIKey: HULDRQRKKXRXBI-UHFFFAOYSA-N
Synonyme
5-Chloro-2-methoxybenzoic acid3438-16-25-Chloro-o-anisic acidEINECS 222-343-7DTXSID80187949RefChem:534942DTXCID90110440222-343-75-Chloro-2-methoxy-benzoic acidMFCD00017546Benzoic acid, 5-chloro-2-methoxy-5-Chloro-2-methoxybenzoicacid2-Methoxy-5-chlorobenzoic Acid5-CHLORO-2-ANISIC ACIDGlibenclamide Impurity 75-Chloro-methoxybenzoic acidSCHEMBL48961orb2695759SCHEMBL6542484SCHEMBL30100412Fr125645-chloro-2-(methyloxy)benzoic acidCK2307SBB063166STL164312AKOS0001122275-Chloro-2-methoxybenzoic acid, 99%CS-W016879EBC-152313FC36354
Quelle anzeigen →
An 110 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→