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918307-91-2 | 2-Penten-2-ol, 4-[(1-methylethyl)imino]-
CAS No: 918307-91-2 Catalog No: AG006GG6 MDL No:
Product Description
Catalog Number:
AG006GG6
Chemical Name:
2-Penten-2-ol, 4-[(1-methylethyl)imino]-
CAS Number:
918307-91-2
Molecular Formula:
C8H15NO
Molecular Weight:
141.2108
IUPAC Name:
4-(propan-2-ylamino)pent-3-en-2-one
InChI:
InChI=1S/C8H15NO/c1-6(2)9-7(3)5-8(4)10/h5-6,9H,1-4H3
InChI Key:
SKKSWNSECDCYOD-UHFFFAOYSA-N
SMILES:
CC(=CC(=NC(C)C)C)O
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.115g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
141.214g/mol
Monoisotopic Mass:
141.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.9
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