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1476-05-7 | 2-Butene, 1-[(1-methyl-2-propen-1-yl)oxy]-
CAS No: 1476-05-7 Catalog No: AG001F0T MDL No:
Product Description
Catalog Number:
AG001F0T
Chemical Name:
2-Butene, 1-[(1-methyl-2-propen-1-yl)oxy]-
CAS Number:
1476-05-7
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
IUPAC Name:
1-but-3-en-2-yloxybut-2-ene
InChI:
InChI=1S/C8H14O/c1-4-6-7-9-8(3)5-2/h4-6,8H,2,7H2,1,3H3
InChI Key:
XYFNXHGRCIZMQQ-UHFFFAOYSA-N
SMILES:
CC=CCOC(C=C)C
Properties
Complexity:
94.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.104g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.199g/mol
Monoisotopic Mass:
126.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2
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