Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Others
Thiazolidine, 3-[(4-nitrophenyl)methyl]- structure
Thiazolidine, 3-[(4-nitrophenyl)methyl]- structure

Thiazolidine, 3-[(4-nitrophenyl)methyl]-

Iupac Name:(2S)-2-[[(5S)-5-amino-5-carboxypentyl]amino]pentanedioic acid
CAS No.:997-68-2
Molecular Weight:276.289
1. Names and Identifiers
1.1 Name
Thiazolidine, 3-[(4-nitrophenyl)methyl]-
1.2 CAS No.
997-68-2
1.3 CID
160556
1.4 Molecular Formula
C8H11N3O (isomer)
1.5 Inchi
InChI=1S/C11H20N2O6/c12-7(10(16)17)3-1-2-6-13-8(11(18)19)4-5-9(14)15/h7-8,13H,1-6,12H2,(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m0/s1
1.6 InChkey
ZDGJAHTZVHVLOT-YUMQZZPRSA-N
1.7 Canonical Smiles
C(CCNC(CCC(=O)O)C(=O)O)CC(C(=O)O)N
1.8 Isomers Smiles
C(CCN[C@@H](CCC(=O)O)C(=O)O)C[C@@H](C(=O)O)N
2. Properties
3.1 Melting Point
257-259 oC (分解)
3.2 Refractive Index
1.537
3. Safety and Handling
4.1 Safety Statements
safetyDesc
4. Computational chemical data
  • Molecular Weight:276.289g/mol
  • Molecular Formula:C8H11N3O
  • Compound Is Canonicalized:True
  • XLogP3-AA:_5.5
  • Exact Mass:276.13213636
  • Monoisotopic Mass:276.13213636
  • Complexity:320
  • Rotatable Bond Count:11
  • Hydrogen Bond Donor Count:5
  • Hydrogen Bond Acceptor Count:8
  • Topological Polar Surface Area:150
  • Heavy Atom Count:19
  • Defined Atom Stereocenter Count:2
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
5. Recommended Suppliers
Global1SuppliersView all >>
  • Products:Pharmaceutical raw materials,Chemical reagent, Food aditives,Plant ExtracPharmaceutical and pesticide intermediates.
  • Tel:86-431-81915458
  • Email:cathytan@jltely.com
L-Glutamic acid,N-[(5S)-5-amino-5-carboxypentyl]- CAS No.: 997-68-2
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/Gram
  • Time: 2020/11/27
Inquire