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Home > Aldehydes > 267668-91-7
267668-91-7 | Benzaldehyde, 2-(2-butynyl)- (9CI)
CAS No: 267668-91-7 Catalog No: AG00BL10 MDL No:
Product Description
Catalog Number:
AG00BL10
Chemical Name:
Benzaldehyde, 2-(2-butynyl)- (9CI)
CAS Number:
267668-91-7
IUPAC Name:
2-but-2-ynylbenzaldehyde
InChI:
InChI=1S/C11H10O/c1-2-3-6-10-7-4-5-8-11(10)9-12/h4-5,7-9H,6H2,1H3
InChI Key:
QEVIDXVHFMUCNV-UHFFFAOYSA-N
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.073g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.2g/mol
Monoisotopic Mass:
158.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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