Structure

2-Deoxy-2,2-difluoro-5-cytidylic acid

CAS
116371-67-6
Catalog Number
ACM116371676
Category
Other Products
Molecular Weight
0
Molecular Formula
C9H12F2N3O7P2.5

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Specification

Synonyms
2-Deoxy-2,2-difluoro-5-cytidylic Acid;Gemcitabine Monophosphate;2,2-Difluoro-2-deoxycytidine 5-phosphoric acid;2,2-Difluoro-2-deoxycytidine-5-phosphoric acid;Gemcitabine Monophosphate Formate Salt;2-Deoxy-2,2-difluoro-5-cytidylic Acid ForMate;GeMcitabine Monophosphate disodiuM salt Monohydrate;2-Deoxy-2,2-difluorocytidine monophosphate formate salt
Melting Point
151-153?C
Density
2.09
What is the molecular formula of 2-Deoxy-2,2-difluoro-5-cytidylic acid?

The molecular formula is C9H12F2N3O7P.

What is the molecular weight of 2-Deoxy-2,2-difluoro-5-cytidylic acid?

The molecular weight is 343.18 g/mol.

What is the CAS number of 2-Deoxy-2,2-difluoro-5-cytidylic acid?

The CAS number is 116371-67-6.

What is the IUPAC name of 2-Deoxy-2,2-difluoro-5-cytidylic acid?

The IUPAC name is [(2R,3R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4,4-difluoro-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate.

What is the InChIKey of 2-Deoxy-2,2-difluoro-5-cytidylic acid?

The InChIKey is KNTREFQOVSMROS-QPPQHZFASA-N.

What is the XLogP3-AA value of 2-Deoxy-2,2-difluoro-5-cytidylic acid?

The XLogP3-AA value is -3.

How many hydrogen bond donor counts does 2-Deoxy-2,2-difluoro-5-cytidylic acid have?

It has 4 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 2-Deoxy-2,2-difluoro-5-cytidylic acid have?

It has 9 hydrogen bond acceptor counts.

How many rotatable bond counts does 2-Deoxy-2,2-difluoro-5-cytidylic acid have?

It has 4 rotatable bond counts.

What is the complexity value of 2-Deoxy-2,2-difluoro-5-cytidylic acid?

The complexity value is 578.

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