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ALPHA-QUINQUETHIOPHENE

ALPHA-QUINQUETHIOPHENE structure

CAS No:
5660-45-7
Formula:
C20H12S5
Chemical Name:
ALPHA-QUINQUETHIOPHENE
Synonyms:
2,2":5",2"":5"",2""":5""",2""""-Quinquethiophene;alpha-Quinquethiophene;NSC700150;2,5-bis(5-thiophen-2-ylthiophen-2-yl)thiophene;Quinquethiphene;SCHEMBL2742433;CHEMBL1978392;CTK5A5404;DTXSID70327897;alpha-Quinquethiophene, >/=95%
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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ALPHA-QUINQUETHIOPHENE Basic Attributes

Molecular Weight：

412.645

Exact Mass：

411.95400

NSC Number：

700150

DSSTox ID：

DTXSID70327897

HScode：

2934999090

Characteristics

PSA：

141

XLogP3：

8.66210

Density：

1.384g/cm3

Melting Point：

253 °C

Boiling Point：

535.2ºC at 760 mmHg

Flash Point：

210.8ºC

Refractive Index：

1.71

Safety Information

Precautionary statement(s)：

P261, P264, P271, P280, P304+P340, P305+P351+P338, P312, P337+P313, P403+P233, P405, P501

Hazard Statements：

H319

Computed Properties

Molecular Weight:412.6
XLogP3:7.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:411.95425625
Monoisotopic Mass:411.95425625
Topological Polar Surface Area:141
Heavy Atom Count:25
Complexity:417
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes