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1-[2-(Dimethylamino)ethyl]-1,2-dihydro-5H-tetrazole-5-thione

1-[2-(Dimethylamino)ethyl]-1,2-dihydro-5H-tetrazole-5-thione structure

CAS No:
61607-68-9
Formula:
C5H11N5S
Chemical Name:
1-[2-(Dimethylamino)ethyl]-1,2-dihydro-5H-tetrazole-5-thione
Synonyms:
5H-Tetrazole-5-thione,1-[2-(dimethylamino)ethyl]-1,2-dihydro-;1-[2-(Dimethylamino)ethyl]-1,2-dihydro-5H-tetrazole-5-thione;1-(2-N,N-Dimethylaminoethyl)-5-mercaptotetrazole;5-Mercapto-1-(2-dimethylaminoethyl)-1H-tetrazole;1-(2-Dimethylaminoethyl)-5-mercapto-1H-tetrazole;1-[2-(Dimethylamino)ethyl]-5-mercaptotetrazole;1-[2-(Dimethylamino)ethyl]-1H-tetrazole-5-thiol;1-[2-(N,N-Dimethylamino)ethyl]-5-mercapto-1H-tetrazole;1-[2-(Dimethylamino)ethyl]-2H-tetrazole-5-thione;1-[2-(Dimethylamino)ethyl]-1H-1,2,3,4-tetrazole-5-thiol
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Pharmaceutical Intermediates > Bulk Drug Intermediates

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1-[2-(Dimethylamino)ethyl]-1,2-dihydro-5H-tetrazole-5-thione Basic Attributes

Molecular Weight：

173.239

Exact Mass：

173.24

EC Number：

262-868-9

DSSTox ID：

DTXSID20210624

HScode：

2933990090

Characteristics

PSA：

85.64000

XLogP3：

0.28

Density：

1.4±0.1 g/cm3

Melting Point：

215 °C (dec.)(lit.)

Boiling Point：

283.7±42.0 °C at 760 mmHg

Flash Point：

125.4±27.9 °C

Refractive Index：

1.663

Safety Information

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26-S36

Marks：

Xi:Irritant

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (97.73%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 51 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:173.24
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:173.07351655
Monoisotopic Mass:173.07351655
Topological Polar Surface Area:75.3
Heavy Atom Count:11
Complexity:178
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1-[2-(Dimethylamino)ethyl]-1H-tetrazole-5-thiol

CAS No.: 61607-68-9

Grade: Industrial Grade

Content: 99%

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Guide of 1-[2-(Dimethylamino)ethyl]-1,2-dihydro-5H-tetrazole-5-thione

Basic Attributes
Characteristics
Safety Information
Computed Properties
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1-[2-(Dimethylamino)ethyl]-1,2-dihydro-5H-tetrazole-5-thione

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