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Home> Hot Product Listed 2   > 2-AMINO-N-FURAN-2-YLMETHYL-3-(1H-INDOL-3-YL)-PROPIONAMIDE
79-33-4 structure

2-AMINO-N-FURAN-2-YLMETHYL-3-(1H-INDOL-3-YL)-PROPIONAMIDE

Iupac Name:(2S)-2-hydroxypropanoic acid
CAS No.:79-33-4
Molecular Weight:90.08
Molecular Formula:C20H41NAO4S (isomer)
Names and Identifiers
Synonyms

2-Amino-N-(2-furylmethyl)-3-(1H-indol-3-yl)propanamide

Inchi
InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m0/s1
InChkey
JVTAAEKCZFNVCJ-REOHCLBHSA-N
Canonical Smiles
CC(C(=O)O)O
Isomers Smiles
C[C@@H](C(=O)O)O
Properties
Melting Point
52-54°C
Boiling Point
385.8°Cat760mmHg
Refractive Index
n20/D 1.427
Flash Point
152.3°C
Alpha
-13.5 o (C=2.5, 1.5N NAOH)
Safety and Handling
Risk Statements
38-41-34-36/37/38-36-35
Safety Statements
26-39-45-36/37/39-36
PackingGroup
III
Transport
3261
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 100000_1000000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
Galactic 2010
Jungbunzlauer S.A. 2012
NatureWorks BV 2010
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

Serious eye damage, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H315 Causes skin irritation

H318 Causes serious eye damage

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

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

Response

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

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

P332+P313 If skin irritation occurs: Get medical advice/attention.

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

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P310 Immediately call a POISON CENTER/doctor/\u2026

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:90.08g/mol
  • Molecular Formula:C20H41NAO4S
  • Compound Is Canonicalized:True
  • XLogP3-AA:_0.7
  • Exact Mass:90.032
  • Monoisotopic Mass:90.032
  • Complexity:59.1
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:57.5A^2
  • Heavy Atom Count:6
  • 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
  • CACTVS Substructure Key Fingerprint: AAADcYBAMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAICCAAAAgAI AACQCAIAAAAAAAAAAAFAAAABEAAAAAAAQAAAAAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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