Formic acid triethylamine complex 5:2

CAT: 0024-sc-250026Size: 50 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-250026Size:50 mL

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CAS Number

15077-13-1

Chemical Information

Formic acid--N,N-diethylethanamine (5/2)

CAS Number	15077-13-1
PubChem CID	16211099
IUPAC Name	bis(N,N-diethylethanamine);formic acid
Molecular Formula	C17H40N2O10
Molecular Weight	432.5
Topological Polar Surface Area	193
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	6
Heavy Atom Count	29
Formal Charge	0
Complexity	35

SMILES

CCN(CC)CC.CCN(CC)CC.C(=O)O.C(=O)O.C(=O)O.C(=O)O.C(=O)O

InChI

InChI=1S/2C6H15N.5CH2O2/c2*1-4-7(5-2)6-3;5*2-1-3/h2*4-6H2,1-3H3;5*1H,(H,2,3)

InChIKey

NLOIHFJXBNFDSF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15077-13-1

CID: 16211099

Formula: C17H40N2O10

MW: 432.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	432.5
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	6
Exact Mass	432.26829548
Monoisotopic Mass	432.26829548
Topological Polar Surface Area	193 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	35.9
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	7
Compound Is Canonicalized	Yes

Catalog	Name
sc-234195	Borane triethylamine complex
sc-215935A	Sulfur trioxide triethylamine complex
sc-215055	Formic acid
sc-215055A	Formic acid
sc-215935	Sulfur trioxide triethylamine complex
sc-504314	5-Bromo-5′-uridylic Acid Triethylamine Salt
sc-228229	Formic acid-13C
sc-257550	Formic acid-d
sc-294988	Formic acid solution
sc-263339	Formic acid-D2

Catalog	Name
OR1030636-01	Formic Acid - Triethylamine Azeotrope
OR72482	Formic Acid - Triethylamine (5:2) Azeotrope
OR61241	Borane triethylamine complex
16308-55	Formic Acid
FS61304-01	Sulfur trioxide triethylamine complex
OR937729-01	Sulfur trioxide-triethylamine complex
289614-01	Sulfur Trioxide - Triethylamine Complex
40120117-1	Formic Acid 1M
HY-Y0488A-01	Formic acid (ammonium)