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75122-75-7 | 3-Pentenoic acid, 2-(diethylamino)-, methyl ester, (E)-
CAS No: 75122-75-7 Catalog No: AG0056L0 MDL No:
Product Description
Catalog Number:
AG0056L0
Chemical Name:
3-Pentenoic acid, 2-(diethylamino)-, methyl ester, (E)-
CAS Number:
75122-75-7
Molecular Formula:
C10H19NO2
Molecular Weight:
185.2634
IUPAC Name:
methyl 2-(diethylamino)pent-3-enoate
InChI:
InChI=1S/C10H19NO2/c1-5-8-9(10(12)13-4)11(6-2)7-3/h5,8-9H,6-7H2,1-4H3
InChI Key:
UAKAUPAKIZBZDK-UHFFFAOYSA-N
SMILES:
C/C=C/C(C(=O)OC)N(CC)CC
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.267g/mol
Monoisotopic Mass:
185.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2
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