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84310-95-2 | Butanoic acid, 2-ethyl-2-[[(phenylmethoxy)carbonyl]amino]-
CAS No: 84310-95-2 Catalog No: AG004XR8 MDL No:
Product Description
Catalog Number:
AG004XR8
Chemical Name:
Butanoic acid, 2-ethyl-2-[[(phenylmethoxy)carbonyl]amino]-
CAS Number:
84310-95-2
Molecular Formula:
C14H19NO4
Molecular Weight:
265.3050
IUPAC Name:
2-ethyl-2-(phenylmethoxycarbonylamino)butanoic acid
InChI:
InChI=1S/C14H19NO4/c1-3-14(4-2,12(16)17)15-13(18)19-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H,15,18)(H,16,17)
InChI Key:
ZYKOGIHAEXNQAE-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)(NC(=O)OCc1ccccc1)CC
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.309g/mol
Monoisotopic Mass:
265.131g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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