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16939-73-4 | ACETIC ACID TRANS-2-HEPTEN-1-YL ESTER
CAS No: 16939-73-4 Catalog No: AG003NMU MDL No:MFCD00036584
Product Description
Catalog Number:
AG003NMU
Chemical Name:
ACETIC ACID TRANS-2-HEPTEN-1-YL ESTER
CAS Number:
16939-73-4
MDL Number:
MFCD00036584
IUPAC Name:
[(E)-hept-2-enyl] acetate
InChI:
InChI=1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h6-7H,3-5,8H2,1-2H3/b7-6+
InChI Key:
AWCPMVVOGVEPRC-VOTSOKGWSA-N
EC Number:
241-002-3
UNII:
1LW02YZ45Q
FEMA Number:
4125
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
156.115g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.225g/mol
Monoisotopic Mass:
156.115g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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