COC(=O)C1=CC(=CC(=C1)OCC2=CC=CC=C2)O
CAS: 54915-31-0
Name: methyl 3-hydroxy-5-phenylmethoxybenzoate
SMILES: COC(=O)C1=CC(=CC(=C1)OCC2=CC=CC=C2)O

Molecular Processing

Molecular formula
C15H14O4
Molecular weight
258.27
Exact mass
258.0892
XLogP
2.76
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
70.22

Supplementary Information

InChIKey: DDPIXQLSJXBHGF-UHFFFAOYSA-N
Synonyme
methyl 3-(benzyloxy)-5-hydroxybenzoate54915-31-0methyl 3-hydroxy-5-phenylmethoxybenzoate3-Benzyloxy-5-hydroxy-benzoic Acid Methyl EsterMFCD06655985Methyl3-(benzyloxy)-5-hydroxybenzoate3-Hydroxy-5-(phenylmethoxy)benzoic Acid Methyl EsterMethyl 3-hydroxy-5-(benzyloxy)benzoateMethyl 3-hydroxy-5-[benzyloxy]benzoatemethyl 3-hydroxy-5-[(phenylmethyl)oxy]benzoatemethyl 3-hydroxy-5-{[phenylmethyl]oxy}benzoate3-benzyloxy-5-hydroxybenzoic acid methyl ester3-Hydroxy-5-benzyloxybenzoic acid methyl esterSCHEMBL90412SCHEMBL29475634DTXSID90428678DDPIXQLSJXBHGF-UHFFFAOYSA-NMethyl 3-benzyloxy-5-hydroxybenzoateAKOS016007237methyl 3-benzyloxy-5-hydroxy-benzoateSB37625SS-4720AC-37339methyl 3-hydroxy-5-phenylmethoxy-benzoateSY102260DB-334792CS-0137229Methyl 3-hydroxy-5{[phenylmethyl]oxy}benzoateF2319463-Hydroxy-5-[phenylmethoxy]benzoic acid, methyl ester
Quelle anzeigen →
An 89 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→