Benzaldehyde, 4-(2,5-dimethyl-1H-pyrrol-1-yl)-


Chemical Name: Benzaldehyde, 4-(2,5-dimethyl-1H-pyrrol-1-yl)-
CAS Number: 95337-70-5
Product Number: AG0036UJ(AGN-PC-0KKQB9)
Synonyms:
MDL No:
Molecular Formula: C13H13NO
Molecular Weight: 199.2484

Identification/Properties


Properties
MP:
82-85 °C
BP:
340.6 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
199.253g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
199.1g/mol
Monoisotopic Mass:
199.1g/mol
Topological Polar Surface Area:
22A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
211
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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