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27460-85-1 | N-tert-Butoxycarbonyl-D-(4-hydroxyphenyl)glycine
CAS No: 27460-85-1 Catalog No: AG003840 MDL No:MFCD01861312
Product Description
Catalog Number:
AG003840
Chemical Name:
N-tert-Butoxycarbonyl-D-(4-hydroxyphenyl)glycine
CAS Number:
27460-85-1
Molecular Formula:
C13H17NO5
Molecular Weight:
267.2778
MDL Number:
MFCD01861312
IUPAC Name:
(2R)-2-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI:
InChI=1S/C13H17NO5/c1-13(2,3)19-12(18)14-10(11(16)17)8-4-6-9(15)7-5-8/h4-7,10,15H,1-3H3,(H,14,18)(H,16,17)/t10-/m1/s1
InChI Key:
LRWJRIFKJPPAPM-SNVBAGLBSA-N
SMILES:
OC(=O)[C@@H](c1ccc(cc1)O)NC(=O)OC(C)(C)C
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
267.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
267.281g/mol
Monoisotopic Mass:
267.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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