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XANTHOPTERIN MONOHYDRATE structure
XANTHOPTERIN MONOHYDRATE structure

XANTHOPTERIN MONOHYDRATE

Iupac Name:2-amino-1,5-dihydropteridine-4,6-dione;hydrate
CAS No.: 5979-01-1
Molecular Weight:197.154
Modify Date.: 2022-03-16 06:12
Introduction: Biochemical research. View more+
1. Names and Identifiers
1.1 Name
XANTHOPTERIN MONOHYDRATE
1.2 Synonyms

2-Amino-4,6-pteridindiol 2-AMINO-4,6-PTERIDINEDIOL 2-aminopteridine-4,6-diol EINECS 204-325-0 MFCD00151242 XANTHOPTERIN HYDRATE XANTHOPTERIN(RG)

1.3 CAS No.
5979-01-1
1.4 CID
2723796
1.5 EINECS(EC#)
611-886-9
1.6 Molecular Formula
C6H7N5O3 (isomer)
1.7 Inchi
InChI=1S/C6H5N5O2.H2O/c7-6-10-4-3(5(13)11-6)9-2(12)1-8-4;/h1H,(H,9,12)(H3,7,8,10,11,13);1H2
1.8 InChkey
GXYCFNCAIXIUMR-UHFFFAOYSA-N
1.9 Canonical Smiles
C1=NC2=C(C(=O)N=C(N2)N)NC1=O.O
1.10 Isomers Smiles
C1=NC2=C(C(=O)N=C(N2)N)NC1=O.O
2. Properties
3.1 Melting point
300℃
3.1 Boiling point
458.7°C at 760 mmHg
3.1 Flash Point
231.2°C
3.1 Precise Quality
197.05500
3.1 PSA
127.27000
3.1 logP
-0.06990
3.1 Appearance
Light yellow to Brown powder to crystal
3.2 Chemical Properties
yellow to orange crystalline powder
3.3 pKa
6.59(at 20℃)
3. Use and Manufacturing
4.1 Definition
Pigmentfound in the wings of butterflies; can be convertedby yeast into folic acid.
4.2 Usage
Biochemical research.
4. Safety and Handling
5.1 Risk Statements
S22-S24/25
5.1 Safety Statements
S24/25
5.1 WGK Germany
3
5.1 Sensitive
Air Sensitive
5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

7. Realated Product Infomation