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1-thiophen-2-ylpentan-1-one

1-thiophen-2-ylpentan-1-one structure

CAS No:
53119-25-8
Formula:
C9H12OS
Chemical Name:
1-thiophen-2-ylpentan-1-one
Synonyms:
Butyl-<2>thienyl-keton; Butyl-thienyl-(2)-keton; 2-thienyl butyl ketone; 1-(2-thienyl)pentan-1-one; 1-(2-Thienyl)-1-pentanone; butyl thophene-2-yl ketone; 1-thien-2-ylpentan-1-one; 1-(thiophen-2-yl)pentan-1-one; 1-[2]Thienyl-pentan-1-on;Expand

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1-thiophen-2-ylpentan-1-one Basic Attributes

Molecular Weight：

168.25600

Exact Mass：

168.06088618 g/mol

UNII：

X71Z1K8RAY

DSSTox ID：

DTXSID10341577

HScode：

2934999090

Characteristics

PSA：

45.31000

XLogP3：

3.12100

Density：

1.051g/cm3

Boiling Point：

262.7ºC

Flash Point：

112.7ºC

Refractive Index：

1.519

Computed Properties

Molecular Weight:168.26
XLogP3:2.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:168.06088618
Monoisotopic Mass:168.06088618
Topological Polar Surface Area:45.3
Heavy Atom Count:11
Complexity:134
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-thiophen-2-ylpentan-1-one

Basic Attributes
Characteristics
Computed Properties

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