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3-isocyanato-4-methylaniline

3-isocyanato-4-methylaniline structure

CAS No:
99626-87-6
Formula:
C8H8N2O
Chemical Name:
3-isocyanato-4-methylaniline
Synonyms:
3-isocyanato-4-methylaniline;Aniline, 3-isocyanato-4-methyl-;99626-87-6;SCHEMBL12945123;DTXSID70244171

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3-isocyanato-4-methylaniline Basic Attributes

Molecular Weight：

148.16 g/mol

Exact Mass：

148.063662883 g/mol

DSSTox ID：

DTXSID70244171

Characteristics

PSA：

55.4 Å²

Computed Properties

Molecular Weight:148.16
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:148.063662883
Monoisotopic Mass:148.063662883
Topological Polar Surface Area:55.4
Heavy Atom Count:11
Complexity:175
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-isocyanato-4-methylaniline

Basic Attributes
Characteristics
Computed Properties

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