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153390-76-2 | Benzaldehyde, 3,5-diethynyl- (9CI)
CAS No: 153390-76-2 Catalog No: AG00AUFG MDL No:
Product Description
Catalog Number:
AG00AUFG
Chemical Name:
Benzaldehyde, 3,5-diethynyl- (9CI)
CAS Number:
153390-76-2
IUPAC Name:
3,5-diethynylbenzaldehyde
InChI:
InChI=1S/C11H6O/c1-3-9-5-10(4-2)7-11(6-9)8-12/h1-2,5-8H
InChI Key:
SHASLAOFDLIIRK-UHFFFAOYSA-N
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.042g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.168g/mol
Monoisotopic Mass:
154.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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