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Molecule
ID:110870
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
P₄S₃
Molecular Mass
220.090044
Exact Mass
219.81125952
Charge
0
InChI
InChI=1S/P4S3/c5-1-2-3(1)7-4(5)6-2
InChIKey
RWQFRHVDPXXRQN-UHFFFAOYSA-N
Canonic Smiles
s1p2sp3p1p3s2
Isomeric Smiles
s1p2sp3p1p3s2
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.0743
LogD (pH = 7.4)
3.0743
Log P
3.0743
Molar Refractivity
39.7034
Polarizability
17.137169
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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Bioactivity
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General Information
Calculated Properties
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RDKit
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IUPAC name
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Synonyms
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IUPAC Traditional name
Registration numbers
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CAS Number
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EC Number
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PubChem SID
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PubChem CID
Properties
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Safety Information
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Physical Property
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Product Information
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
MP Biomedicals
05216714
Academic Data
PubChem
14818
Names and Identifiers
IUPAC name
3,5,7-trithia-1,2,4,6-tetraphosphatricyclo[2.2.1.0^{2,6}]heptane
Synonyms
PHOSPHORUS SESQUISULFIDE
IUPAC Traditional name
phosphorus sesquisulfide
Registration numbers
CAS Number
1314-85-8
EC Number
215-245-0
PubChem SID
162103035
PubChem CID
14818
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay
Properties
Safety Information
Risk Statements
R:
11
-
22
-
50
Source
Safety Statements
S:
7
-
16
-
61
-
24/25
Source
MSDS Link
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Source
European Hazard Symbols
Flammable (F)
Source
Harmful (Xn)
RTECS
TH4330000
Source
Physical Property
Boiling Point
407°C
Source
Melting Point
172.5°C
Source
Product Information
Certificate of Analysis
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Source
来源