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3,4-dihydroisoquinoline-2(1H)-carbothioamide

3,4-dihydroisoquinoline-2(1H)-carbothioamide structure

CAS No:
31964-52-0
Formula:
C10H12N2S
Chemical Name:
3,4-dihydroisoquinoline-2(1H)-carbothioamide
Synonyms:
3,4-dihydroisoquinoline-2(1H)-carbothioamide;UKRORGSYN-BB BBV-033980;3,4-dihydroisoquinoline-2(1H)-carbothioamide(SALTDATA: FREE);3,4-dihydro-1H-isoquinoline-2-carbothioic acid amide;2(1H)-Isoquinolinecarbothioamide, 3,4-dihydro-

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3,4-dihydroisoquinoline-2(1H)-carbothioamide Basic Attributes

Molecular Weight：

192.28

Exact Mass：

192.07211956

DSSTox ID：

DTXSID60588596

Characteristics

Density：

1.251±0.06 g/cm3

Boiling Point：

340.6±52.0 °C(Predicted)

PKA：

15.43±0.20

Safety Information

wgk germany：

Computed Properties

Molecular Weight:192.28
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:192.07211956
Monoisotopic Mass:192.07211956
Topological Polar Surface Area:61.4
Heavy Atom Count:13
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,4-dihydroisoquinoline-2(1H)-carbothioamide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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