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Aquilegiolide

Aquilegiolide structure

CAS No:
94481-79-5
Formula:
C8H8O3
Chemical Name:
Aquilegiolide
Synonyms:
Aquilegiolide;2(6H)-Benzofuranone, 7,7a-dihydro-6-hydroxy-, (6S,7aS)-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Aquilegiolide Basic Attributes

Molecular Weight：

152.15

Exact Mass：

152.047344113 g/mol

Characteristics

PSA：

46.5 Å²

Density：

1.35±0.1 g/cm3

Melting Point：

77-79 °C(Solv: benzene (71-43-2))

Boiling Point：

447.0±45.0 °C(Predicted)

PKA：

13.31±0.20

Drug Information

MeSH Entry Terms：

aquilegiolide

Computed Properties

Molecular Weight:152.15
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:152.047344113
Monoisotopic Mass:152.047344113
Topological Polar Surface Area:46.5
Heavy Atom Count:11
Complexity:252
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Shaanxi Dideu Medichem Co. Ltd Contact Supplier

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Aquilegiolide

CAS No.: 94481-79-5

Grade: Chemical Grade

Content: 95%

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