Text Search
Structure Search

2-{[(benzyloxy)carbonyl](methyl)amino}-3-phenylpropanoic acid

2-{[(benzyloxy)carbonyl](methyl)amino}-3-phenylpropanoic acid

CAS: 81134-79-4

Formula: C18H19NO4

SMILES: CN(C(CC1=CC=CC=C1)C(O)=O)C(=O)OCC1=CC=CC=C1

IUPAC: 2-{[(benzyloxy)carbonyl](methyl)amino}-3-phenylpropanoic acid

InChI: InChI=1/C18H19NO4/c1-19(18(22)23-13-15-10-6-3-7-11-15)16(17(20)21)12-14-8-4-2-5-9-14/h2-11,16H,12-13H2,1H3,(H,20,21)

Composition: C (69.00%), H (6.11%), N (4.47%), O (20.42%)

Molar Mass: 313.353

Atom Count: 42

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 313.131408096
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey JDGXKNMKNMSHRJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.69
Topological Polar Surface Area 66.84
Polarizability 33.38
Ring Count 2
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <10 Days 81134-79-4 Quote Only
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 81134-79-4 $176.54-$278.68$176.54$278.68
Request Quote