(2S)-2-amino-3-phenylpropanoic acid;trichlorosilane

C9H12Cl3NO2Si — CID 158938721

IUPAC(2S)-2-amino-3-phenylpropanoic acid;trichlorosilane
SMILESCl[SiH](Cl)Cl.N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C9H11NO2.Cl3HSi/c10-8(9(11)12)6-7-4-2-1-3-5-7;1-4(2)3/h1-5,8H,6,10H2,(H,11,12);4H/t8-;/m0./s1
InChIKeyJJZBHESWCKMGPJ-QRPNPIFTSA-N
MW300.65 g/mol
LogP2.06
Rot. Bonds3

About (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane

(2S)-2-amino-3-phenylpropanoic acid;trichlorosilane (PubChem CID 158938721) has the molecular formula C9H12Cl3NO2Si and a molecular weight of 300.65 g/mol. Its IUPAC name is (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane.

Molecular Properties

Compound Name(2S)-2-amino-3-phenylpropanoic acid;trichlorosilane
PubChem CID158938721
Molecular FormulaC9H12Cl3NO2Si
Molecular Weight300.65 g/mol
Exact Mass298.97
IUPAC Name(2S)-2-amino-3-phenylpropanoic acid;trichlorosilane
SMILESCl[SiH](Cl)Cl.N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C9H11NO2.Cl3HSi/c10-8(9(11)12)6-7-4-2-1-3-5-7;1-4(2)3/h1-5,8H,6,10H2,(H,11,12);4H/t8-;/m0./s1
InChIKeyJJZBHESWCKMGPJ-QRPNPIFTSA-N
XLogP2.06
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.65
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-3-((613C)cyclohexatrienyl)propanoic acid
CID 66995721
(2S)-2-amino-3-phenylpropanoic acid;azane
CID 163512949
2-amino-3-phenylpropanoic acid;azane
CID 174393642
(2S)-2-amino-3-phenylpropanoic acid;niobium
CID 175055112
(2S)-2-amino-3-phenylpropanoic acid;astatane
CID 174857071
(2S)-2-amino-3-phenylpropanoic acid;λ2-stannane
CID 175107963
(2S)-2-amino-3-phenylpropanoic acid;(2R)-2-amino-3-phenylpropanoic acid;ethane
CID 161384193
sodium;(2R)-2-amino-3-phenylpropanoic acid;chloride
CID 174870632
CID 70476310
CID 70476310
acetylene;(2S)-2-amino-3-phenylpropanoic acid
CID 158164827
2-amino-3-phenylpropanoic acid;ethane
CID 91596942
2-amino-3-phenylpropanoic acid;chlorobenzene
CID 174438338

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane?
The IUPAC name of (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane (CID 158938721) is (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane.
What is the SMILES notation for (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane?
The canonical SMILES for (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane is Cl[SiH](Cl)Cl.N[C@@H](Cc1ccccc1)C(=O)O.
What is the InChIKey of (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane?
The InChIKey is JJZBHESWCKMGPJ-QRPNPIFTSA-N. The full InChI is InChI=1S/C9H11NO2.Cl3HSi/c10-8(9(11)12)6-7-4-2-1-3-5-7;1-4(2)3/h1-5,8H,6,10H2,(H,11,12);4H/t8-;/m0./s1.
What are the key properties of (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane?
(2S)-2-amino-3-phenylpropanoic acid;trichlorosilane has a molecular weight of 300.65 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-phenylpropanoic acid;trichlorosilane is sourced from PubChem (CID 158938721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).