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10436-25-6 | Boc-11-aminoundecanoic acid
CAS No: 10436-25-6 Catalog No: AG003OF9 MDL No:MFCD00076902
Product Description
Catalog Number:
AG003OF9
Chemical Name:
Boc-11-aminoundecanoic acid
CAS Number:
10436-25-6
Molecular Formula:
C16H31NO4
Molecular Weight:
301.4216
MDL Number:
MFCD00076902
IUPAC Name:
11-[(2-methylpropan-2-yl)oxycarbonylamino]undecanoic acid
InChI:
InChI=1S/C16H31NO4/c1-16(2,3)21-15(20)17-13-11-9-7-5-4-6-8-10-12-14(18)19/h4-13H2,1-3H3,(H,17,20)(H,18,19)
InChI Key:
HPTPZJBSQUULAV-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCCCNC(=O)OC(C)(C)C
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.225g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
301.427g/mol
Monoisotopic Mass:
301.225g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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