CCOC1=CC=CC=C1C(=O)O
CAS: 134-11-2
Name: 2-ethoxybenzoic acid
SMILES: CCOC1=CC=CC=C1C(=O)O

Molecular Processing

Molecular formula
C9H10O3
Molecular weight
166.18
Exact mass
166.063
XLogP
1.78
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
44.57

Supplementary Information

InChIKey: XDZMPRGFOOFSBL-UHFFFAOYSA-N
Synonyme
2-Ethoxybenzoic acid134-11-2o-Ethoxybenzoic acidBenzoic acid, 2-ethoxy-Benzoic acid, o-ethoxy-5IN9FDI7TTortho-Ethoxybenzoic acidNSC-406710DTXSID3059638RefChem:86834DTXCID2034176205-130-3MFCD00002438Benzoic acid, ethoxy-Ethoxybenzoic acid2-Ethoxybenzoic Acid; NSC 406710; o-Ethoxybenzoic Acid2-EthoxybenzoicacidEINECS 205-130-32-ethoxybenzoic-acidNSC 4067102-ethoxy benzoic acid2-Ethoxy-benzoic AcidAI3-06193UNII-5IN9FDI7TT2-(ethyloxy)benzoic acid2-Ethoxybenzoic acid, 98%30734-87-3SCHEMBL124831SCHEMBL599865orb3030519
Quelle anzeigen →
An 41 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→