Text Search
Structure Search

3-amino-3-(2,4,6-trimethoxyphenyl)propanoic acid

3-amino-3-(2,4,6-trimethoxyphenyl)propanoic acid

CAS: 682804-44-0

Formula: C12H17NO5

SMILES: COC1=CC(OC)=C(C(N)CC(O)=O)C(OC)=C1

IUPAC: 3-amino-3-(2,4,6-trimethoxyphenyl)propanoic acid

InChI: InChI=1/C12H17NO5/c1-16-7-4-9(17-2)12(10(5-7)18-3)8(13)6-11(14)15/h4-5,8H,6,13H2,1-3H3,(H,14,15)

Composition: C (56.46%), H (6.71%), N (5.49%), O (31.34%)

Molar Mass: 255.27

Atom Count: 35

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 255.110672651
Formal Charge 0
FSP3 0.42
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey SLGONOCYZIRARZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.38
Topological Polar Surface Area 91.01
Polarizability 25.5
Ring Count 1
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Struchem co.,ltd
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 682804-44-0 $1,860.00-$3,300.00$1,860.00$2,420.00$3,300.00
Request Quote