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1-BENZYL-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLICACID

1-BENZYL-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLICACID structure

CAS No:
3807-61-2
Formula:
C14H15NO2
Chemical Name:
1-BENZYL-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLICACID

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1-BENZYL-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLICACID Basic Attributes

Molecular Weight：

229.279

Exact Mass：

229.11000

DSSTox ID：

DTXSID20359067

HScode：

2933990090

Characteristics

PSA：

42.23000

XLogP3：

2.85140

Density：

1.12g/cm3

Boiling Point：

402.4ºC at 760mmHg

Flash Point：

197.2ºC

Computed Properties

Molecular Weight:229.27
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:229.110278721
Monoisotopic Mass:229.110278721
Topological Polar Surface Area:42.2
Heavy Atom Count:17
Complexity:273
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-BENZYL-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLICACID

Basic Attributes
Characteristics
Computed Properties

1-BENZYL-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLICACID

SDS

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