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6970-66-7 | Butanamide, N-ethyl-2,2-bis(hydroxymethyl)-
CAS No: 6970-66-7 Catalog No: AG005IVK MDL No:
Product Description
Catalog Number:
AG005IVK
Chemical Name:
Butanamide, N-ethyl-2,2-bis(hydroxymethyl)-
CAS Number:
6970-66-7
Molecular Formula:
C8H17NO3
Molecular Weight:
175.2255
IUPAC Name:
N-ethyl-2,2-bis(hydroxymethyl)butanamide
InChI:
InChI=1S/C8H17NO3/c1-3-8(5-10,6-11)7(12)9-4-2/h10-11H,3-6H2,1-2H3,(H,9,12)
InChI Key:
XSBWVNXCDBPILO-UHFFFAOYSA-N
SMILES:
CCNC(=O)C(CO)(CO)CC
NSC Number:
62038
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.121g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
175.228g/mol
Monoisotopic Mass:
175.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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