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309263-55-6 | 1-Pentene, 1-bromo-1-methoxy-4-methyl-, (1E)-
CAS No: 309263-55-6 Catalog No: AG0031OF MDL No:
Product Description
Catalog Number:
AG0031OF
Chemical Name:
1-Pentene, 1-bromo-1-methoxy-4-methyl-, (1E)-
CAS Number:
309263-55-6
Molecular Formula:
C7H13BrO
Molecular Weight:
193.0815
IUPAC Name:
1-bromo-1-methoxy-4-methylpent-1-ene
InChI:
InChI=1S/C7H13BrO/c1-6(2)4-5-7(8)9-3/h5-6H,4H2,1-3H3
InChI Key:
ATQJYUTWBXTHAR-UHFFFAOYSA-N
SMILES:
CO/C(=C\CC(C)C)/Br
Properties
Complexity:
97.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.015g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.084g/mol
Monoisotopic Mass:
192.015g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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