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Boc-his(3-me)-oh

CAS No.:
61070-22-2
Catalog Number:
AG00EC5X
Molecular Formula:
C12H19N3O4
Molecular Weight:
269.2970
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 99% (HPLC)
1 week
United States
$177
- +
1g
≥ 99% (HPLC)
1 week
United States
$440
- +
5g
≥ 99% (HPLC)
1 week
United States
$1924
- +
Product Description
Catalog Number:
AG00EC5X
Chemical Name:
Boc-his(3-me)-oh
CAS Number:
61070-22-2
Molecular Formula:
C12H19N3O4
Molecular Weight:
269.2970
MDL Number:
MFCD00076945
IUPAC Name:
(2S)-3-(3-methylimidazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C12H19N3O4/c1-12(2,3)19-11(18)14-9(10(16)17)5-8-6-13-7-15(8)4/h6-7,9H,5H2,1-4H3,(H,14,18)(H,16,17)/t9-/m0/s1
InChI Key:
BGZFLUIZBZNCTI-VIFPVBQESA-N
SMILES:
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1cncn1C C12H19N3O4
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
269.138g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
269.301g/mol
Monoisotopic Mass:
269.138g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties