Text Search
Structure Search

2,3-bis(benzyloxy)butanedioic acid

2,3-bis(benzyloxy)butanedioic acid

CAS: 622-00-4

Formula: C18H18O6

SMILES: OC(=O)C(OCC1=CC=CC=C1)C(OCC1=CC=CC=C1)C(O)=O

IUPAC: 2,3-bis(benzyloxy)butanedioic acid

InChI: InChI=1/C18H18O6/c19-17(20)15(23-11-13-7-3-1-4-8-13)16(18(21)22)24-12-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,19,20)(H,21,22)

Composition: C (65.45%), H (5.49%), O (29.06%)

Molar Mass: 330.336

Atom Count: 42

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 330.1103383
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey ZRRDKHFYTWVMFV-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.94
Topological Polar Surface Area 93.06
Polarizability 33.41
Ring Count 2
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
96% <5 Days 622-00-4 $739.00-$830.00$739.00$830.00
Request Quote