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6-isothiocyanato-7-methoxy-4-methylchromen-2-one

6-isothiocyanato-7-methoxy-4-methylchromen-2-one structure

CAS No:
501079-99-8
Formula:
C12H9NO3S
Chemical Name:
6-isothiocyanato-7-methoxy-4-methylchromen-2-one
Synonyms:
NSC299880;6-isothiocyanato-7-methoxy-4-methyl-benzopyran-2-one;NSC-299880;501079-99-8

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6-isothiocyanato-7-methoxy-4-methylchromen-2-one Basic Attributes

Molecular Weight：

247.27 g/mol

Exact Mass：

247.03031432 g/mol

NSC Number：

299880

Characteristics

PSA：

80 Å²

XLogP3：

2.8443

Melting Point：

165 - 168 °C

Computed Properties

Molecular Weight:247.27
XLogP3:3.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:247.03031432
Monoisotopic Mass:247.03031432
Topological Polar Surface Area:80
Heavy Atom Count:17
Complexity:401
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-isothiocyanato-7-methoxy-4-methylchromen-2-one

Basic Attributes
Characteristics
Computed Properties

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