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N-(2,5-Dimethylpyrrol-L-yl)formamide

HCID 145646
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
143800-06-0
Standard SMILES
Cc1ccc(C)n1NC=O
InChIKey
JKTLFKQRLWMPSQ-UHFFFAOYSA-N
Molecular formula
C7H10N2O
Average molar mass
138.17 g/mol
Monoisotopic mass
138.07931295

Names & identifiers

Preferred name
N-(2,5-Dimethylpyrrol-L-yl)formamide
IUPAC
N-(2,5-dimethylpyrrol-1-yl)formamide
English name
N-(2,5-dimethylpyrrol-1-yl)formamide
Molecular formula
C7H10N2O
Molecular weight
138.17

Names & synonyms

143800-06-0N-(2,5-Dimethylpyrrol-L-yl)formamideN-(2,5-Dimethyl-1H-pyrrol-1-yl)formamideN-(2,5-dimethylpyrrol-1-yl)formamideDTXSID80162554Formamide, N-(2,5-dimethyl-1H-pyrrol-1-yl)-

Database identifiers

CAS
143800-06-0
PubChem CID
145646
DTXSID
DTXSID80162554

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
34 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
117

Physicochemical properties

Boiling point
246.7 · 246.7±43.0 °C(Predicted)
Density
1.08 · 1.08±0.1 g/cm3(Predicted)
pka
8.45 · 8.45±0.23(Predicted)

Chemistry & industry

Upstream & downstream products

Downstream products

(2,5-dimethylpyrrol-1-yl)urea

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

Related reactions

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Compound notes

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