structure of 6-amino-3-hydroxy-1-methyl-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile

6-amino-3-hydroxy-1-methyl-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile

CAS No.: 1000931-42-9
M. Wt: 188.19
M. Fa: C9H8N4O
InChI Key: DDCLSIXTOMWXBA-UHFFFAOYSA-N

Names and Identifiers of 1000931-42-9

CAS Number

1000931-42-9

MDL Number

MFCD35095872

IUPAC Name

6-amino-3-hydroxy-1-methyl-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile

InChI

InChI=1S/C9H8N4O/c1-13-4-7(14)6-2-5(3-10)8(11)12-9(6)13/h2,4,14H,1H3,(H2,11,12)

InChIKey

DDCLSIXTOMWXBA-UHFFFAOYSA-N

Canonical SMILES

CN1C=C(O)C2=CC(C#N)=C(N)N=C21

UNSPSC Code

12352100

Physical and chemical properties of 1000931-42-9

H Bond Acceptors

4

H Bond Donors

2

LogP

0.763535945333333

Molecular Formula

C9H8N4O

Molecular Weight

188.19

Safety Information of 1000931-42-9

Pictograms

Signal Word

 Warning

Safety Data Sheet
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