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Methyl 4-[[[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoate

Methyl 4-[[[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoate structure

CAS No:
675602-57-0
Formula:
C17H18N2O4
Chemical Name:
Methyl 4-[[[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoate
Synonyms:
Benzoic acid,4-[[[(4-methylphenyl)methyl]amino]methyl]-3-nitro-,methyl ester;Methyl 4-[[[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoate

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Methyl 4-[[[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoate Basic Attributes

Molecular Weight：

314.33600

Exact Mass：

314.34

DSSTox ID：

DTXSID90374909

Characteristics

PSA：

84.15000

XLogP3：

3.89370

Density：

1.219g/cm3

Boiling Point：

458.9ºC at 760 mmHg

Flash Point：

231.4ºC

Refractive Index：

1.59

Computed Properties

Molecular Weight:314.34
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:314.12665706
Monoisotopic Mass:314.12665706
Topological Polar Surface Area:84.2
Heavy Atom Count:23
Complexity:402
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Methyl 4-[[[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoate

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

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