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4-Methyl-2-oxo-2H-1-benzopyran-7-yl nonan-1-oate

HCID 87584
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
18319-93-2
Standard SMILES
CCCCCCCCC(=O)Oc1ccc2c(C)cc(=O)oc2c1
InChIKey
IEJIWAFZZKFSFV-UHFFFAOYSA-N
Molecular formula
C19H24O4
Average molar mass
316.4 g/mol
Monoisotopic mass
316.16745924

Names & identifiers

Preferred name
4-Methyl-2-oxo-2H-1-benzopyran-7-yl nonan-1-oate
IUPAC
(4-methyl-2-oxochromen-7-yl) nonanoate
English name
4-METHYLUMBELLIFERYL NONANOATE
Molecular formula
C19H24O4
Molecular weight
316.39

Names & synonyms

4-Methyl-2-oxo-2H-1-benzopyran-7-yl nonan-1-oateEINECS 242-208-6DTXSID10171396Nonanoic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl esterNonanoic acid, ester with 7-hydroxy-4-methylcoumarinRefChem:99738DTXCID6093887242-208-618319-93-24-METHYLUMBELLIFERYL NONANOATE4-methyl-2-oxo-2H-chromen-7-yl nonanoate(4-methyl-2-oxochromen-7-yl) nonanoate
Show more names
4-METHYLUMBELLIFERYL 7-NONANOATE4-MethylumbelliferylNonanoateA.R.
MFCD00051220Nonanoic acid 4-methylumbelliferyl ester(4-Methyl-2-oxo-chromen-7-yl) nonanoate4-Mu-Nonanoate4-methyl-2-oxochromen-7-yl nonanoate4-Methylumbelliferyl nonoateSCHEMBL336958Nonanoic acid 4-methyl-2-oxo-2H-1-benzopyran-7-yl ester

Database identifiers

CAS
18319-93-2
PubChem CID
87584
DTXSID
DTXSID10171396
EC Number
242-208-6
Nikkaji
J266.121G

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
52.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
23
Formal charge
0
Complexity
441

Physicochemical properties

Boiling point
453.2 · 453.2±40.0 °C(Predicted)
Density
1.097 · 1.097±0.06 g/cm3(Predicted)
storage temp.
-20 °C · -20°C
form
crystals
color
White
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
280 · P280-P302+P352-P362+P364
HS Code
2932209090 · 2932209090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2932209090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P280-P302+P352-P362+P364

Chemistry & industry

Applications

Uses4-Methylumbelliferyl nonanoate is a fluorogenic substrate of esterases. 4-Methylumbelliferyl nonanoate can be hydrolyzed to 4-methylumbelliferone with bright blue fluorescence[1].

Suppliers15 total

上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
韶关市启程生物科技有限公司18122215013 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
武汉市恒瑞信泰生物医药科技有限公司027-027-65522215 18163303831 · [email protected]
深圳市金赛途生物科技有限公司0755-23251735 13302967066 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
上海楷森生物科技有限公司17558870519 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
江苏艾康生物医药研发有限公司17714375163 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]