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Benzeneethanamine, 2,5-dimethoxy-4-(heptylthio)-, (Z)-2-butenedioate ( 1:1)

Benzeneethanamine, 2,5-dimethoxy-4-(heptylthio)-, (Z)-2-butenedioate ( 1:1) structure

CAS No:
129658-28-2
Formula:
C17H29NO2S.C4H4O4
Chemical Name:
Benzeneethanamine, 2,5-dimethoxy-4-(heptylthio)-, (Z)-2-butenedioate ( 1:1)
Synonyms:
Benzeneethanamine, 2,5-dimethoxy-4-(heptylthio)-, (Z)-2-butenedioate (1:1);ACMC-20mtbn;CTK0H7833

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Benzeneethanamine, 2,5-dimethoxy-4-(heptylthio)-, (Z)-2-butenedioate ( 1:1) Basic Attributes

Molecular Weight：

427.559

Exact Mass：

427.202859

Characteristics

PSA：

144

XLogP3：

4.67960

Boiling Point：

430.6ºC at 760 mmHg

Flash Point：

214.2ºC

Vapor Pressure：

1.28E-07mmHg at 25°C

Computed Properties

Molecular Weight:427.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:13
Exact Mass:427.20285895
Monoisotopic Mass:427.20285895
Topological Polar Surface Area:144
Heavy Atom Count:29
Complexity:372
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Benzeneethanamine, 2,5-dimethoxy-4-(pentylthio)-, (Z)-2-butenedioate ( 1:1)

129658-10-2

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Guide of Benzeneethanamine, 2,5-dimethoxy-4-(heptylthio)-, (Z)-2-butenedioate ( 1:1)

Basic Attributes
Characteristics
Computed Properties
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Benzeneethanamine, 2,5-dimethoxy-4-(heptylthio)-, (Z)-2-butenedioate ( 1:1)

SDS

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