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2-Amino-3-[[[4-(methylthio)phenyl]methylene]amino]-2-butenedinitrile

2-Amino-3-[[[4-(methylthio)phenyl]methylene]amino]-2-butenedinitrile structure

CAS No:
914636-21-8
Formula:
C12H10N4S
Chemical Name:
2-Amino-3-[[[4-(methylthio)phenyl]methylene]amino]-2-butenedinitrile
Synonyms:
2-Butenedinitrile,2-amino-3-[[[4-(methylthio)phenyl]methylene]amino]-;2-Amino-3-[[[4-(methylthio)phenyl]methylene]amino]-2-butenedinitrile

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2-Amino-3-[[[4-(methylthio)phenyl]methylene]amino]-2-butenedinitrile Basic Attributes

Molecular Weight：

242.3

Exact Mass：

242.30

Characteristics

PSA：

111 Å²

XLogP3：

2.74516

Density：

1.17±0.1 g/cm3 (20 °C, 760 mmHg)

Boiling Point：

450.1±45.0 °C (760 mmHg)

Computed Properties

Molecular Weight:242.30
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:242.06261751
Monoisotopic Mass:242.06261751
Topological Polar Surface Area:111
Heavy Atom Count:17
Complexity:412
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Amino-3-[[[4-(methylthio)phenyl]methylene]amino]-2-butenedinitrile

Basic Attributes
Characteristics
Computed Properties

2-Amino-3-[[[4-(methylthio)phenyl]methylene]amino]-2-butenedinitrile

SDS

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