Home Sulfos (S)-2-(((9H-Fluoren-9-yl)methoxy)carbonylamino)-6-(2-nitrophenylsulfonamido)hexanoic acid

(S)-2-(((9H-Fluoren-9-yl)methoxy)carbonylamino)-6-(2-nitrophenylsulfonamido)hexanoic acid

CAS No.:
359780-63-5
Catalog Number:
AG00I74N
Molecular Formula:
C27H27N3O8S
Molecular Weight:
553.5836
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 99% (HPLC)
1 week
United States
$126
- +
1g
≥ 99% (HPLC)
1 week
United States
$213
- +
5g
≥ 99% (HPLC)
1 week
United States
$871
- +
Product Description
Catalog Number:
AG00I74N
Chemical Name:
(S)-2-(((9H-Fluoren-9-yl)methoxy)carbonylamino)-6-(2-nitrophenylsulfonamido)hexanoic acid
CAS Number:
359780-63-5
Molecular Formula:
C27H27N3O8S
Molecular Weight:
553.5836
MDL Number:
MFCD22989438
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[(2-nitrophenyl)sulfonylamino]hexanoic acid
InChI:
InChI=1S/C27H27N3O8S/c31-26(32)23(13-7-8-16-28-39(36,37)25-15-6-5-14-24(25)30(34)35)29-27(33)38-17-22-20-11-3-1-9-18(20)19-10-2-4-12-21(19)22/h1-6,9-12,14-15,22-23,28H,7-8,13,16-17H2,(H,29,33)(H,31,32)/t23-/m0/s1
InChI Key:
PRVUNKPLPKHEPV-QHCPKHFHSA-N
SMILES:
O=C(N[C@H](C(=O)O)CCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])OCC1c2ccccc2c2c1cccc2 C27H27N3O8S
Properties
Complexity:
943  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
553.152g/mol
Formal Charge:
0
Heavy Atom Count:
39  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
553.586g/mol
Monoisotopic Mass:
553.152g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
176A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties