2-ethyl-1,4-diazepane, 95%

Name: 2-ethyl-1,4-diazepane
Brand: Chempure

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CAS Number

105627-83-6

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IUPAC name	2-ethyl-1,4-diazepane
inchi	InChI=1S/C7H16N2/c1-2-7-6-8-4-3-5-9-7/h7-9H,2-6H2,1H3
inchi key	JMMAYWRNZMVHST-UHFFFAOYSA-N
molecular formula	C7H16N2
synonyms	2-ethyl-1,4-diazepane 105627-83-6 starbld0039420 2-ethylperhydro-1,4-diazepine SCHEMBL2462390

Computed Properties

Molecular Weight:	128.22 g/mol
XLogP3:	0.5
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	1
Exact Mass:	128.131348519 g/mol
Monoisotopic Mass:	128.131348519 g/mol
Topological Polar Surface Area:	24.1 Å²
Heavy Atom Count:	9
Formal Charge:	0
Complexity:	73.3
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	1
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: AY9335

2-ethyl-1,4-diazepane, 95%

Product No: AY9335

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