Home Other Building Blocks 1,5,5-trimethylpyrrolidin-3-one

1,5,5-trimethylpyrrolidin-3-one

CAS No.:
77130-94-0
Catalog Number:
AG01B6U5
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
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Product Description
Catalog Number:
AG01B6U5
Chemical Name:
1,5,5-trimethylpyrrolidin-3-one
CAS Number:
77130-94-0
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
MDL Number:
MFCD24707562
IUPAC Name:
1,5,5-trimethylpyrrolidin-3-one
InChI:
InChI=1S/C7H13NO/c1-7(2)4-6(9)5-8(7)3/h4-5H2,1-3H3
InChI Key:
FFMZNWQZSSNWHV-UHFFFAOYSA-N
SMILES:
O=C1CN(C(C1)(C)C)C
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties