2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE
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![2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0cd689026f7b4046a468b2d80688ef09.png "2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE")
2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE
structure -
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CAS No:
147005-91-2
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Formula:
C7H5ClN2OS
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Chemical Name:
2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE
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Synonyms:
2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE;2-(chloromethyl)thieno[3,2-d]pyrimidin-4(3H)-one;thieno[3,2-d]pyrimidin-4(3H)-one, 2-(chloromethyl)-;2-(chloromethyl)thieno[3,2-d]pyrimidin-4(3H)-one(SALTDATA: FREE);2-(chloromethyl)-1H-thieno[2,3-e]pyrimidin-4-one
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CAS No:
2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE Basic Attributes
200.65
199.98100
DTXSID70368447
2934999090
Characteristics
69.7
1.72340
1.69±0.1 g/cm3(Predicted)
357.5ºC at 760 mmHg
170ºC
1.764
2.71E-05mmHg at 25°C
Safety Information
IRRITANT
22
Xn
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:200.65
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:199.9811117
Monoisotopic Mass:199.9811117
Topological Polar Surface Area:69.7
Heavy Atom Count:12
Complexity:244
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
2-CHLOROMETHYL-3H-THIENO[3,2-D]PYRIMIDIN-4-ONE
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