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2,4-dihydroxy-3,3-dimethylbutanamide

2,4-dihydroxy-3,3-dimethylbutanamide

CAS: 4417-86-1

Formula: C6H13NO3

SMILES: CC(C)(CO)C(O)C(N)=O

IUPAC: 2,4-dihydroxy-3,3-dimethylbutanamide

InChI: InChI=1/C6H13NO3/c1-6(2,3-8)4(9)5(7)10/h4,8-9H,3H2,1-2H3,(H2,7,10)

Composition: C (48.97%), H (8.90%), N (9.52%), O (32.61%)

Molar Mass: 147.174

Atom Count: 23

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 147.089543283
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey VNQLNIMYRMBBIN-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 35.83
Topological Polar Surface Area 83.55
Polarizability 14.31
Ring Count 0
Rotatable Bond Count 3

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95% <2 Days 4417-86-1 $51.35-$539.70$51.35$63.37$86.31$113.62$180.26$539.70
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