(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea, 95%

Name: (3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea
Brand: Chempure

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CAS Number

1152526-78-7

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About this item

IUPAC name	3,4-dihydro-2H-1,5-benzodioxepin-7-ylthiourea
inchi	InChI=1S/C10H12N2O2S/c11-10(15)12-7-2-3-8-9(6-7)14-5-1-4-13-8/h2-3,6H,1,4-5H2,(H3,11,12,15)
inchi key	BPTFVQBOOQPKRJ-UHFFFAOYSA-N
molecular formula	C10H12N2O2S
synonyms	(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea 1152526-78-7 3,4-dihydro-2H-1,5-benzodioxepin-7-ylthiourea CWB52678 AKOS005205282

Computed Properties

Molecular Weight:	224.28 g/mol
XLogP3:	1.2
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	1
Exact Mass:	224.06194880 g/mol
Monoisotopic Mass:	224.06194880 g/mol
Topological Polar Surface Area:	88.6 Å²
Heavy Atom Count:	15
Formal Charge:	0
Complexity:	238
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

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Product No: BA6881

(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiourea, 95%

Product No: BA6881

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