Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Food Additives  /  Pharmaceutical Intermediates  /  Others  /  Organic Intermediate  /  Custom Manufacturing
2-Furancarboxamide, N-[(dimethylamino)iminomethyl]- structure
2-Furancarboxamide, N-[(dimethylamino)iminomethyl]- structure

2-Furancarboxamide, N-[(dimethylamino)iminomethyl]-

Iupac Name:(2S)-2-aminohexanoic acid
CAS No.:327-57-1
Molecular Weight:131.17300
1. Names and Identifiers
1.1 Name
2-Furancarboxamide, N-[(dimethylamino)iminomethyl]-
1.2 CAS No.
327-57-1
1.3 CID
21236
1.4 Molecular Formula
C17H26N2O3·2CLH (isomer)
1.5 Inchi
InChI=1S/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1
1.6 InChkey
LRQKBLKVPFOOQJ-YFKPBYRVSA-N
1.7 Canonical Smiles
CCCCC(C(=O)O)N
1.8 Isomers Smiles
CCCC[C@@H](C(=O)O)N
2. 3D Conformer
3. Properties
3.1 Melting Point
300ºC
3.2 Refractive Index
23 ° (C=5, 5mol/L HCl)
3.3 Alpha
22 º (C=2, 6N HCL)
4. Safety and Handling
4.1 Risk Statements
R43
4.2 Safety Statements
S22-S24/25
5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin sensitization, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H317 May cause an allergic skin reaction

Precautionary statement(s)
Prevention

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P272 Contaminated work clothing should not be allowed out of the workplace.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

Response

P302+P352 IF ON SKIN: Wash with plenty of water/...

P333+P313 If skin irritation or rash occurs: Get medical advice/attention.

P321 Specific treatment (see ... on this label).

P362+P364 Take off contaminated clothing and wash it before reuse.

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

6. Computational chemical data
  • Molecular Weight:131.17300g/mol
  • Molecular Formula:C17H26N2O3·2CLH
  • Compound Is Canonicalized:True
  • XLogP3-AA:
  • Exact Mass:131.094628657
  • Monoisotopic Mass:131.094628657
  • Complexity:93.1
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:63.3
  • Heavy Atom Count:9
  • Defined Atom Stereocenter Count:1
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
8. Recommended Suppliers
Global121SuppliersView all >>
  • Products:Chemical products
  • Tel:86-571-88938639
  • Email:sales-gc@chinadayangchem.com
L-Norleucine
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/Kilogram
  • Time: 2019/12/20
Inquire
  • Products:Veterinary products,Nutrition products,Agrochemicals,Active pharmaceutical Ingredients,Custom systhesis,Contract manufacturing
  • Tel:86-571-85829052
  • Email:market@royalpharms.com
L-Norleucine
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 100 USD/Kilogram
  • Time: 2019/12/06
Inquire
  • Products:Peptides; Amino acids and derivates;Antibodies
  • Tel:86-21-15301650010
H-Nle-OH
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 500 USD/Kilogram
  • Time: 2019/12/20
Inquire
  • Products:Career Henan Chemical Co, facing global High-tech pharmaceutical raw materials, high complex new type intermediates, fine chemicals custom synthesis, scale-up production and Rare chemicals trade.
  • Tel:86-371-86658258
alpha-Aminocaproic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/Kilogram
  • Time: 2019/05/21
Inquire
  • Products:Pharmaceutical Intermediate; Pharmaceutical Raw Materials; Raw Steroid Powders; Raw Hormone Powders; etc
  • Tel:86-188-74586545
L-Norleucine
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/Kilogram
  • Time: 2019/03/26
Inquire