Name: Name:1-Boc-5-cyano-3-hydroxymethylindole
Brand: Angene
SKU: AG00IGOE
Rating: 90 (10 reviews)

1-Boc-5-cyano-3-hydroxymethylindole

CAS No.:

914349-11-4

Catalog Number:

AG00IGOE

Molecular Formula:

C15H16N2O3

Molecular Weight:

272.2991

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

96%

In Stock USA

United States

$100

- +

96%

In Stock USA

United States

$300

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Catalog Number:

AG00IGOE

Chemical Name:

1-Boc-5-cyano-3-hydroxymethylindole

CAS Number:

914349-11-4

Molecular Formula:

C15H16N2O3

Molecular Weight:

272.2991

MDL Number:

MFCD05864719

IUPAC Name:

tert-butyl 5-cyano-3-(hydroxymethyl)indole-1-carboxylate

InChI:

InChI=1S/C15H16N2O3/c1-15(2,3)20-14(19)17-8-11(9-18)12-6-10(7-16)4-5-13(12)17/h4-6,8,18H,9H2,1-3H3

InChI Key:

CWAWIDMLDLCCNP-UHFFFAOYSA-N

SMILES:

OCc1cn(c2c1cc(C#N)cc2)C(=O)OC(C)(C)C

Complexity:

421

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

272.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

272.304g/mol

Monoisotopic Mass:

272.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1