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Fmoc-asp(o-1-ad)-oh

CAS No.:
118534-81-9
Catalog Number:
AG008T42
Molecular Formula:
C29H31NO6
Molecular Weight:
489.5595
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 97% (HPLC)
1 week
United States
$174
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Product Description
Catalog Number:
AG008T42
Chemical Name:
Fmoc-asp(o-1-ad)-oh
CAS Number:
118534-81-9
Molecular Formula:
C29H31NO6
Molecular Weight:
489.5595
MDL Number:
MFCD00077309
IUPAC Name:
(2S)-4-(1-adamantyloxy)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoic acid
InChI:
InChI=1S/C29H31NO6/c31-26(36-29-13-17-9-18(14-29)11-19(10-17)15-29)12-25(27(32)33)30-28(34)35-16-24-22-7-3-1-5-20(22)21-6-2-4-8-23(21)24/h1-8,17-19,24-25H,9-16H2,(H,30,34)(H,32,33)/t17?,18?,19?,25-,29?/m0/s1
InChI Key:
VLMHFLIBCSCIRT-QDPBCONJSA-N
SMILES:
O=C(N[C@H](C(=O)O)CC(=O)O[C@]12C[C@H]3C[C@@H](C2)C[C@@H](C1)C3)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
809  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
489.215g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
489.568g/mol
Monoisotopic Mass:
489.215g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2  
Properties