Text Search
Structure Search

3-methoxy-4-{[(1-phenylethyl)carbamoyl]methoxy}benzoic acid

3-methoxy-4-{[(1-phenylethyl)carbamoyl]methoxy}benzoic acid

CAS: 824973-67-3

Formula: C18H19NO5

SMILES: COC1=CC(=CC=C1OCC(=O)NC(C)C1=CC=CC=C1)C(O)=O

IUPAC: 3-methoxy-4-{[(1-phenylethyl)carbamoyl]methoxy}benzoic acid

InChI: InChI=1/C18H19NO5/c1-12(13-6-4-3-5-7-13)19-17(20)11-24-15-9-8-14(18(21)22)10-16(15)23-2/h3-10,12H,11H2,1-2H3,(H,19,20)(H,21,22)

Composition: C (65.64%), H (5.82%), N (4.25%), O (24.29%)

Molar Mass: 329.352

Atom Count: 43

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 329.126322716
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey CUZDZYIPJMXWST-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.08
Topological Polar Surface Area 84.86
Polarizability 34.04
Ring Count 2
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Crea-Chim UAB
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 824973-67-3 $65.00$65.00
Request Quote