Text Search
Structure Search

(2R)-2-[(tert-butoxycarbonyl)amino]-5-phenylpent-4-enoic acid

(2R)-2-[(tert-butoxycarbonyl)amino]-5-phenylpent-4-enoic acid

CAS: 261380-19-2

Formula: C16H21NO4

SMILES: CC(C)(C)OC(=O)N[C@H](CC=CC1=CC=CC=C1)C(O)=O

IUPAC: (2R)-2-{[(tert-butoxy)carbonyl]amino}-5-phenylpent-4-enoic acid

InChI: InChI=1S/C16H21NO4/c1-16(2,3)21-15(20)17-13(14(18)19)11-7-10-12-8-5-4-6-9-12/h4-10,13H,11H2,1-3H3,(H,17,20)(H,18,19)/t13-/m1/s1

Composition: C (65.96%), H (7.27%), N (4.81%), O (21.97%)

Molar Mass: 291.347

Atom Count: 42

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 291.14705816
Formal Charge 0
FSP3 0.37
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey OIMOFNCGPRURIA-CYBMUJFWSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.31
Topological Polar Surface Area 75.63
Polarizability 30.92
Ring Count 1
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 261380-19-2 $82.80-$702.77$82.80$198.72$702.77
Request Quote
AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 261380-19-2 $126.50-$824.55$126.50$255.30$824.55
Request Quote