Text Search
Structure Search

2-amino-4-(methylsulfanyl)(3,3,4,4-²H?)butanoic acid

2-amino-4-(methylsulfanyl)(3,3,4,4-²H?)butanoic acid

CAS: 93709-61-6

Formula: C5H11NO2S

SMILES: [2H]C([2H])(SC)C([2H])([2H])C(N)C(O)=O

IUPAC: 2-amino-4-(methylsulfanyl)(3,3,4,4-²H?)butanoic acid

InChI: InChI=1/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/i2D2,3D2

Composition: C (39.19%), H (4.60%), [2H] (5.26%), N (9.14%), O (20.88%), S (20.92%)

Molar Mass: 153.23

Atom Count: 20

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 153.076156756
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey FFEARJCKVFRZRR-RRVWJQJTNA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.59
Topological Polar Surface Area 63.32
Polarizability 15.07
Ring Count 0
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
CLEARSYNTH LABS
Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 93709-61-6 $122.40-$978.18$122.40$978.18
Request Quote