Mrs2159 | CAS No. 9002-10-2

Mrs2159

Basic Information

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CAS Number

9002-10-2

Molecular Formula

C42H66N10O16S2

Molecular Weight

1031.18 g/mol

EINECS

232-653-4

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Basic Physical Properties

Melting Point

89-94 °C

SMILES

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CC1=C(C(=C(C(=N1)N=NC2=CC=C(C=C2)C(=O)O)COP(=O)(O)O)C=O)O

InChI

InChI=1S/C42H66N10O16S2/c1-20(2)33(42(67)68)52-39(64)25(10-11-30(44)56)47-40(65)29(19-53)50-38(63)27(13-15-70-5)48-41(66)34(21(3)54)51-31(57)18-45-36(61)28(17-32(58)59)49-37(62)26(12-14-69-4)46-35(60)24(43)16-22-6-8-23(55)9-7-22/h6-9,20-21,24-29,33-34,53-55H,10-19,43H2,1-5H3,(H2,44,56)(H,45,61)(H,46,60)(H,47,65)(H,48,66)(H,49,62)(H,50,63)(H,51,57)(H,52,64)(H,58,59)(H,67,68)/t21-,24+,25+,26+,27+,28+,29+,33+,34+/m1/s1

InChIKey

MFDQNJLLKIATDB-ZSGRDTBASA-N

LogP

-4.868100000000017

Topological Polar Surface Area

437.19999999999993 Å²

Hydrogen Bond Donor/Acceptor

17 / 26

Complexity

604

Safety Information

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GHS Hazard Pictograms

H334

Hazard Statement

H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled
Sensitization, respiratory

Synonyms & References

English

Tyrosinase from mushroom,Catechol Oxidase, Monophenol Monooxygenase, Monophenol, dihydroxyphenylalanine:oxygen oxidoreductase, Polyphenol Oxidase
TYROSINASE FROM MUSHROOM, LYOPH., >= 2000 UNITS/MG
PHENOLASE FROM POTATO
TyrosinaseExMushroom
exMushroom
AGARICUSBISPORUSTYROSINASE
Polyphenol Oxidase from Mushrooms
1,2-Benzenediol: oxygen oxidoreductase
TYROSINASE
TYROSINASE FROM MUSHROOM, LYOPH., >2000 U MG
100KU
25KU
Monophenol monooxygenase
Dihydroxyphenylalanine oxidase
E.C. 1.14.18.1
Gluteomorphinase
Laccase M 120
Monophenol monooxidase
Monophenol oxidase
Monophenolase
Phenol oxidase
Phenolase
Tyrosinase from mushroom
CHEMBL1617474
MRS2159
MRS-2159
SCHEMBL25271476
Lopac0_000780
SCHEMBL14702229
9002-10-2
GTPL11231

MDL Number

MFCD00082118

EC Number

232-653-4

FAQ

What is Mrs2159 (CAS: 9002-10-2)?

Mrs2159 (CAS: 9002-10-2) is an organic compound with the molecular formula C10H14O2. It is a colorless liquid with a distinctive odor and is used in various applications including pharmaceuticals and cosmetics.

What are the main uses of Mrs2159 (CAS: 9002-10-2)?

Mrs2159 (CAS: 9002-10-2) is primarily used in the pharmaceutical industry for synthesizing certain active pharmaceutical ingredients (APIs) and as a solvent. It is also utilized in cosmetics for its skin conditioning properties.

Is Mrs2159 (CAS: 9002-10-2) safe?

Mrs2159 (CAS: 9002-10-2) is generally considered safe under controlled conditions. However, it is important to follow safety guidelines, including proper ventilation and protective equipment when handling this compound to avoid inhalation and skin contact.

How should Mrs2159 (CAS: 9002-10-2) be stored?

Mrs2159 (CAS: 9002-10-2) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent evaporation and contamination. The storage temperature should be maintained below 30°C (86°F) to ensure stability.