sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 3-Hydroxymethyl-5-methoxyindole-1-carboxylic acid tert-butyl ester

3-Hydroxymethyl-5-methoxyindole-1-carboxylic acid tert-butyl ester

CAS No.:
600136-09-2
Catalog Number:
AG00E9V6
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$79
- +
5g
95%
In Stock USA
United States
$238
- +
10g
95%
In Stock USA
United States
$388
- +
Product Description
Catalog Number:
AG00E9V6
Chemical Name:
3-Hydroxymethyl-5-methoxyindole-1-carboxylic acid tert-butyl ester
CAS Number:
600136-09-2
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
MDL Number:
MFCD05864718
IUPAC Name:
tert-butyl 3-(hydroxymethyl)-5-methoxyindole-1-carboxylate
InChI:
InChI=1S/C15H19NO4/c1-15(2,3)20-14(18)16-8-10(9-17)12-7-11(19-4)5-6-13(12)16/h5-8,17H,9H2,1-4H3
InChI Key:
OYKYYDIURXPHSS-UHFFFAOYSA-N
SMILES:
OCc1cn(c2c1cc(OC)cc2)C(=O)OC(C)(C)C
Properties
Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties