Basic information
- CAS
19246-18-5- Standard SMILES
N[C@@H](CS)C(=O)NCC(=O)O- InChIKey
ZUKPVRWZDMRIEO-VKHMYHEASA-N- Molecular formula
- C5H10N2O3S
- Average molar mass
- 178.21 g/mol
- Monoisotopic mass
- 178.04121336
Names & identifiers
- Preferred name
- L-Cysteinylglycine
- IUPAC
- 2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]acetic acid
- English name
- Cys-Gly
- Molecular formula
- C5H10N2O3S
- Molecular weight
- 178.21
Names & synonyms
Show more names
Database identifiers
- CAS
19246-18-5- PubChem CID
- 439498
- DTXSID
DTXSID10864877- ChEMBL
CHEMBL371579- ChEBI
CHEBI:4047- UNII
- 384644SZ9T
- EC Number
- 633-715-7
- Nikkaji
- J36.789C
Properties
Computed structural properties
- XLogP
- -3.7
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 162
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 158 · 158 - 160oC
- Boiling point
- 459 · 459.0±45.0 °C(Predicted)
- Density
- 1.373 · 1.373±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- DMSO (Slightly), Methanol (Slightly), Water (Slightly)
- pka
- 3.02 · 3.02±0.10(Predicted)
- form
- Solid
- color
- White to Off-White
- Stability
- Air Sensitive
- InChI
- 1S/C5H10N2O3S/c6-3(2-11)5(10)7-1-4(8)9/h3,11H,1-2,6H2,(H,7,10)(H,8,9)
- InChIKey
- ZUKPVRWZDMRIEO-UHFFFAOYSA-N
- SMILES
- NC(CS)C(=O)NCC(O)=O
- FDA UNII
- 384644 SZ9T · 384644SZ9T
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 26 · NA.26
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 301 · P301+P312+P330-P305+P351+P338
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36
- Safety Statements
- 26 · 26
- WGK Germany
- 3 · 3
- RTECS
- 9285800 · MB9285800
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Irrit. 2
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- rtecs
- MB9285800
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H319
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- Precautionary statements
- P301+P312+P330-P305+P351+P338
Chemistry & industry
Pharmacology
Applications
UsesCys-Gly has been used for derivatization by p-hydroxymercury benzoate (PHMB) for calibration of reversed phase chromatography coupled on-line and sequentially with a UVvisible diode array detector (RPLC-DAD).
General DescriptionCys-Gly, a dipeptide is a catabolic byproduct of glutathione.
Suppliers100 total
Additional notes
DefinitionChEBI: A dipeptide consisting of glycine having an L-cysteinyl attached to its alpha-amino group. It is an intermediate metabolite in glutathione metabolism.
Related reactions
Compound notes
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