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86114-18-3 | 4-Pentenal, 3-methyl-, (R)-
CAS No: 86114-18-3 Catalog No: AG004L2O MDL No:
Product Description
Catalog Number:
AG004L2O
Chemical Name:
4-Pentenal, 3-methyl-, (R)-
CAS Number:
86114-18-3
Molecular Formula:
C6H10O
Molecular Weight:
98.1430
IUPAC Name:
(3R)-3-methylpent-4-enal
InChI:
InChI=1S/C6H10O/c1-3-6(2)4-5-7/h3,5-6H,1,4H2,2H3/t6-/m0/s1
InChI Key:
MWSZRPZREJBOIP-LURJTMIESA-N
SMILES:
O=CC[C@H](C=C)C
Properties
Complexity:
66.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
98.073g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.145g/mol
Monoisotopic Mass:
98.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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