CAS
92953-12-3 Purity
96%
92953-12-3 Purity
96%
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1,4-Decadiyne
CAS
929-53-3
Catalog Number
ACM929533
Category
Other Products
Molecular Weight
134.22
Molecular Formula
C10H14
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Specification
Synonyms
1,5-Decadiyne, 1,4-Decadiyne, SBB008878, 53963-03-4, 929-53-3
IUPAC Name
deca-1,5-diyne
InChI Key
IWIDILFDSIIOSB-UHFFFAOYSA-N
Boiling Point
68ºC (5 torr)
Flash Point
57.1ºC
Density
0.82
Exact Mass
134.11000
H-Bond Acceptor
0
H-Bond Donor
0
Packing Group
II
Safety Description
S16-S24/25-S29-S33
What is the molecular formula of 1,4-Decadiyne?
Molecular Formula: C10H14
What is the molecular weight of 1,4-Decadiyne?
Molecular Weight: 134.22 g/mol
What is the IUPAC name of 1,4-Decadiyne?
IUPAC Name: deca-1,4-diyne
What is the InChI of 1,4-Decadiyne?
InChI: InChI=1S/C10H14/c1-3-5-7-9-10-8-6-4-2/h1H,4-6,8,10H2,2H3
What is the InChIKey of 1,4-Decadiyne?
InChIKey: PITHRTPWTQFONM-UHFFFAOYSA-N
What is the canonical SMILES of 1,4-Decadiyne?
Canonical SMILES: CCCCCC#CCC#C
What is the XLogP3-AA value of 1,4-Decadiyne?
XLogP3-AA: 3.7
How many hydrogen bond donor count does 1,4-Decadiyne have?
Hydrogen Bond Donor Count: 0
What is the topological polar surface area of 1,4-Decadiyne?
Topological Polar Surface Area: 0.2
Is the compound canonicalized?
Compound Is Canonicalized: Yes
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