2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine

C42H93NO3Sn3 — CID 16689184

IUPAC2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine
SMILESCCCC[Sn](CCCC)(CCCC)OCCN(CCO[Sn](CCCC)(CCCC)CCCC)CCO[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C6H12NO3.9C4H9.3Sn/c8-4-1-7(2-5-9)3-6-10;9*1-3-4-2;;;/h1-6H2;9*1,3-4H2,2H3;;;/q-3;;;;;;;;;;3*+1
InChIKeyINVJAZBYQZJOEU-UHFFFAOYSA-N
MW1016.34 g/mol
LogP14.38
Rot. Bonds39

About 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine

2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine (PubChem CID 16689184) has the molecular formula C42H93NO3Sn3 and a molecular weight of 1016.34 g/mol. Its IUPAC name is 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine.

Molecular Properties

Compound Name2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine
PubChem CID16689184
Molecular FormulaC42H93NO3Sn3
Molecular Weight1016.34 g/mol
Exact Mass1019.42
IUPAC Name2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine
SMILESCCCC[Sn](CCCC)(CCCC)OCCN(CCO[Sn](CCCC)(CCCC)CCCC)CCO[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C6H12NO3.9C4H9.3Sn/c8-4-1-7(2-5-9)3-6-10;9*1-3-4-2;;;/h1-6H2;9*1,3-4H2,2H3;;;/q-3;;;;;;;;;;3*+1
InChIKeyINVJAZBYQZJOEU-UHFFFAOYSA-N
XLogP14.38
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds39
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001016.34
LogP ≤ 514.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

trioctyl(pentoxy)stannane
CID 87643879
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CID 141193186
dibutyl-ethyl-heptoxystannane
CID 87371470
dibutyl-ethyl-nonoxystannane
CID 87372414
diethyl-hexoxy-octylstannane
CID 149251797
N,N-bis(2-ethoxyethyl)butan-1-amine
CID 91213413
tributyl-[butyl(dipentoxy)stannyl]oxystannane
CID 87861161
N-dodecyl-N-(2-methoxyethyl)dodecan-1-amine
CID 167224233
N-butyl-N-[2-[2-(diethylamino)ethoxy]ethyl]butan-1-amine
CID 19822695
N-(2-methoxyethyl)-N-nonylnonan-1-amine
CID 6426107
dibutyl-[dibutyl(dodecyl)stannyl]oxy-dodecylstannane
CID 18432072
N,N-dibutylbutan-1-amine;trihydrate
CID 173345147

Frequently Asked Questions

What is the IUPAC name of 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine?
The IUPAC name of 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine (CID 16689184) is 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine.
What is the SMILES notation for 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine?
The canonical SMILES for 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine is CCCC[Sn](CCCC)(CCCC)OCCN(CCO[Sn](CCCC)(CCCC)CCCC)CCO[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine?
The InChIKey is INVJAZBYQZJOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12NO3.9C4H9.3Sn/c8-4-1-7(2-5-9)3-6-10;9*1-3-4-2;;;/h1-6H2;9*1,3-4H2,2H3;;;/q-3;;;;;;;;;;3*+1.
What are the key properties of 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine?
2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine has a molecular weight of 1016.34 g/mol, XLogP of 14.38, 39 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tributylstannyloxy-N,N-bis(2-tributylstannyloxyethyl)ethanamine is sourced from PubChem (CID 16689184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).