Text Search
Structure Search

(2R,3R)-2-amino-3-(4-methoxyphenyl)butanoic acid hydrochloride

(2R,3R)-2-amino-3-(4-methoxyphenyl)butanoic acid hydrochloride

CAS: 2716848-88-1

Formula: C11H16ClNO3

SMILES: Cl.COC1=CC=C(C=C1)[C@@H](C)[C@@H](N)C(O)=O

IUPAC: (2R,3R)-2-amino-3-(4-methoxyphenyl)butanoic acid hydrochloride

InChI: InChI=1S/C11H15NO3.ClH/c1-7(10(12)11(13)14)8-3-5-9(15-2)6-4-8;/h3-7,10H,12H2,1-2H3,(H,13,14);1H/t7-,10-;/m1./s1

Composition: C (53.77%), H (6.56%), Cl (14.43%), N (5.70%), O (19.53%)

Molar Mass: 245.7

Atom Count: 32

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 245.0818711
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey PJYPIAPZWDWXKO-YZUKSGEXSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.05
Topological Polar Surface Area 72.55
Polarizability 22.25
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
J&W PHARMLAB LLC
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 2716848-88-1 $342.70-$7,912.00$342.70$457.70$687.70$1,147.70$2,162.00$7,912.00
Request Quote