CAS
908271-38-5 Purity
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908271-38-5 Purity
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4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde
CAS
908287-21-8
Catalog Number
ACM908287218
Category
Other Products
Molecular Weight
181.582
Molecular Formula
C7H4ClN3O
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Specification
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
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
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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