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NSC360042

NSC360042 structure

CAS No:
74174-29-1
Formula:
C17H16O5
Chemical Name:
NSC360042
Synonyms:
NSC360042;Haginin A;2H-1-Benzopyran-7-ol, 3-(4-hydroxy-2,3-dimethoxyphenyl)-

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NSC360042 Basic Attributes

Molecular Weight：

300.31

Exact Mass：

300.09977361 g/mol

NSC Number：

360042

DSSTox ID：

DTXSID40320471

Characteristics

PSA：

68.2 Å²

Density：

1.319±0.06 g/cm3

Melting Point：

128-130 °C

Boiling Point：

520.9±50.0 °C(Predicted)

PKA：

9.45±0.20

Drug Information

MeSH Entry Terms：

haginin A

NSC360042 Use and Manufacturing

Use Classification：

Polyketides [PK] -> Flavonoids [PK12] -> Isoflavans [PK1208]

Computed Properties

Molecular Weight:300.30
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:300.09977361
Monoisotopic Mass:300.09977361
Topological Polar Surface Area:68.2
Heavy Atom Count:22
Complexity:410
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of NSC360042

Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties

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