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CCRIS7058

CCRIS7058 structure

CAS No:
88973-46-0
Formula:
C6H6O3
Chemical Name:
CCRIS7058
Synonyms:
CCRIS 7058;6-oxohexa-2,4-dienoic acid
Categories:
Biochemical Engineering > Lipids

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CCRIS7058 Basic Attributes

Molecular Weight：

126.11

Exact Mass：

126.031694049 g/mol

Characteristics

PSA：

54.4 Å²

Density：

1.2048

Boiling Point：

174.21°C (rough estimate)

Refractive Index：

1.4189 (estimate)

Toxicity：

msc-ham-lng 32 mmol/L EMMUEG 24,112,94

Drug Information

MeSH Entry Terms：

(E,E)-6-oxohexadienoic acid

Computed Properties

Molecular Weight:126.11
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:126.031694049
Monoisotopic Mass:126.031694049
Topological Polar Surface Area:54.4
Heavy Atom Count:9
Complexity:156
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of CCRIS7058

Basic Attributes
Characteristics
Drug Information
Computed Properties
Learn More Other Chemicals

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