sales@angenesci.com
Login | Register
logo
Structures Search
Home Nitros 1-Boc-3-hydroxymethyl-5-nitroindole

1-Boc-3-hydroxymethyl-5-nitroindole

CAS No.:
914349-07-8
Catalog Number:
AG00GV0X
Molecular Formula:
C14H16N2O5
Molecular Weight:
292.2872
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$94
- +
5g
96%
In Stock USA
United States
$294
- +
10g
96%
In Stock USA
United States
$494
- +
Product Description
Catalog Number:
AG00GV0X
Chemical Name:
1-Boc-3-hydroxymethyl-5-nitroindole
CAS Number:
914349-07-8
Molecular Formula:
C14H16N2O5
Molecular Weight:
292.2872
MDL Number:
MFCD05864712
IUPAC Name:
tert-butyl 3-(hydroxymethyl)-5-nitroindole-1-carboxylate
InChI:
InChI=1S/C14H16N2O5/c1-14(2,3)21-13(18)15-7-9(8-17)11-6-10(16(19)20)4-5-12(11)15/h4-7,17H,8H2,1-3H3
InChI Key:
ZMPACHXTNKWGMG-UHFFFAOYSA-N
SMILES:
OCc1cn(c2c1cc(cc2)[N+](=O)[O-])C(=O)OC(C)(C)C
Properties
Complexity:
415  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.106g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
292.291g/mol
Monoisotopic Mass:
292.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties