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Thiopropionamide

Thiopropionamide structure

CAS No:
631-58-3
Formula:
C3H7NS
Chemical Name:
Thiopropionamide
Synonyms:
Thiopropionamide;Propanethioamide;Thiopropanamide;propiothioamide;methylthioacetamide;3-propanethioamide;Propanethioamide #;NSC400115;thiopropionic acid amide;ACMC-209ndi
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Thiopropionamide Basic Attributes

Molecular Weight：

89.16

Exact Mass：

89.029922

NSC Number：

400115

DSSTox ID：

DTXSID80375268

HScode：

2930909090

Characteristics

PSA：

58.1

XLogP3：

0.2

Density：

1.0±0.1 g/cm3

Melting Point：

40ºC

Boiling Point：

133.9°C at 760 mmHg

Flash Point：

34.8±22.6 °C

Refractive Index：

1.530

Safety Information

hazard class code：

R20/21/22

safety instructions：

22-36/37/39

Marks：

Precautionary statement(s)：

P201, P202, P261, P264, P270, P271, P273, P280, P281, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P308+P313, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P273, P280, P281, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P308+P313, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:89.16
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:89.02992040
Monoisotopic Mass:89.02992040
Topological Polar Surface Area:58.1
Heavy Atom Count:5
Complexity:42.2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 631-58-3

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