tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine

C15H38ClNOSi2 — CID 87920596

IUPACtert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine
SMILESCC(C)(C)[Si](C)(C)Cl.CC(CN)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C9H23NOSi.C6H15ClSi/c1-8(7-10)11-12(5,6)9(2,3)4;1-6(2,3)8(4,5)7/h8H,7,10H2,1-6H3;1-5H3
InChIKeyXFOPEHOHNSSFAV-UHFFFAOYSA-N
MW340.10 g/mol
LogP5.59
Rot. Bonds3

About tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine

tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine (PubChem CID 87920596) has the molecular formula C15H38ClNOSi2 and a molecular weight of 340.10 g/mol. Its IUPAC name is tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine.

Molecular Properties

Compound Nametert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine
PubChem CID87920596
Molecular FormulaC15H38ClNOSi2
Molecular Weight340.10 g/mol
Exact Mass339.22
IUPAC Nametert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine
SMILESCC(C)(C)[Si](C)(C)Cl.CC(CN)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C9H23NOSi.C6H15ClSi/c1-8(7-10)11-12(5,6)9(2,3)4;1-6(2,3)8(4,5)7/h8H,7,10H2,1-6H3;1-5H3
InChIKeyXFOPEHOHNSSFAV-UHFFFAOYSA-N
XLogP5.59
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.10
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

(3R)-3-[tert-butyl(dimethyl)silyl]oxybutan-1-amine
CID 88577810
butan-2-yloxy-tert-butyl-dimethylsilane;methane
CID 158755840
3-[tert-butyl(dimethyl)silyl]oxybutan-1-ol
CID 554645
(2R)-2-[tert-butyl(dimethyl)silyl]oxy-N,N-dimethylpropan-1-amine
CID 156904543
tert-butyl-[(2S)-4-iodobutan-2-yl]oxy-dimethylsilane
CID 10946949
tert-butyl-(4-iodobutan-2-yloxy)-dimethylsilane
CID 11130810
tert-butyl-dimethyl-pent-4-yn-2-yloxysilane
CID 588048
lithium tert-butyl-dimethyl-[(2R)-pentan-2-yl]oxysilane
CID 177428939
tert-butyl-dimethyl-pentadecan-2-yloxysilane
CID 6430239
(2R,4S)-4-[tert-butyl(dimethyl)silyl]oxy-2-methylpentanenitrile
CID 11009699
tert-butyl-dimethyl-tridecan-2-yloxysilane
CID 102272520
(2R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-2-methylpentanal
CID 102285060

Frequently Asked Questions

What is the IUPAC name of tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine?
The IUPAC name of tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine (CID 87920596) is tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine.
What is the SMILES notation for tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine?
The canonical SMILES for tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine is CC(C)(C)[Si](C)(C)Cl.CC(CN)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine?
The InChIKey is XFOPEHOHNSSFAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NOSi.C6H15ClSi/c1-8(7-10)11-12(5,6)9(2,3)4;1-6(2,3)8(4,5)7/h8H,7,10H2,1-6H3;1-5H3.
What are the key properties of tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine?
tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine has a molecular weight of 340.10 g/mol, XLogP of 5.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-chloro-dimethylsilane;2-[tert-butyl(dimethyl)silyl]oxypropan-1-amine is sourced from PubChem (CID 87920596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).