4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde

CAS
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CAS
908287-21-8
Size
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Purity
96%
Price
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Catalog Number

ACM908287218

Product Name

4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde

Structure

Structure

CAS

908287-21-8

Category

Heterocyclic Organic Compound

Synonyms

4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde, 908287-21-8, CTK8B5923, MolPort-019-918-584, ANW-51142, AKOS015850503, PB11007, RP08960, AK-27665, BR-27665, KB-241702, AM20120308, FT-0684798, W9340, C-8624, 4-CHLORO-7H-PYRROLO[2,3-D]PYRIMIDINE-5-CARBOXALDEHYDE, 7H-PYRROLO[2,3-D]PYRIMIDINE-5-CARBOXALDEHYDE, 4-CHLORO-

IUPAC Name

4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde

Molecular Weight

181.582

Molecular Formula

C₇H₄ClN₃O

Canonical SMILES

C1=C(C2=C(N1)N=CN=C2Cl)C=O

InChI Key

SEGITDCEHFAQNG-UHFFFAOYSA-N

Exact Mass

181.00400

H-Bond Acceptor

3

H-Bond Donor

1

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The molecular formula is C7H4ClN3O.

What is the molecular weight of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The molecular weight is 181.58 g/mol.

What is the IUPAC name of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The IUPAC name is 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde.

What is the InChI of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The InChI is InChI=1S/C7H4ClN3O/c8-6-5-4(2-12)1-9-7(5)11-3-10-6/h1-3H,(H,9,10,11).

What is the InChIKey of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The InChIKey is SEGITDCEHFAQNG-UHFFFAOYSA-N.

What is the Canonical SMILES of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The Canonical SMILES is C1=C(C2=C(N1)N=CN=C2Cl)C=O.

What is the CAS number of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The CAS number is 908287-21-8.

What is the XLogP3-AA value of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde?

The XLogP3-AA value is 1.1.

Is 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde a canonicalized compound?

Yes, it is a canonicalized compound.

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