sodium;2-(2-chlorophenyl)acetic acid;hydride

C8H8ClNaO2 — CID 174699179

IUPACsodium;2-(2-chlorophenyl)acetic acid;hydride
SMILESO=C(O)Cc1ccccc1Cl.[H-].[Na+]
InChIInChI=1S/C8H7ClO2.Na.H/c9-7-4-2-1-3-6(7)5-8(10)11;;/h1-4H,5H2,(H,10,11);;/q;+1;-1
InChIKeyBNZAFNWCLGUUOI-UHFFFAOYSA-N
MW194.59 g/mol
LogP-0.92
Rot. Bonds2

About sodium;2-(2-chlorophenyl)acetic acid;hydride

sodium;2-(2-chlorophenyl)acetic acid;hydride (PubChem CID 174699179) has the molecular formula C8H8ClNaO2 and a molecular weight of 194.59 g/mol. Its IUPAC name is sodium;2-(2-chlorophenyl)acetic acid;hydride.

Molecular Properties

Compound Namesodium;2-(2-chlorophenyl)acetic acid;hydride
PubChem CID174699179
Molecular FormulaC8H8ClNaO2
Molecular Weight194.59 g/mol
Exact Mass194.01
IUPAC Namesodium;2-(2-chlorophenyl)acetic acid;hydride
SMILESO=C(O)Cc1ccccc1Cl.[H-].[Na+]
InChIInChI=1S/C8H7ClO2.Na.H/c9-7-4-2-1-3-6(7)5-8(10)11;;/h1-4H,5H2,(H,10,11);;/q;+1;-1
InChIKeyBNZAFNWCLGUUOI-UHFFFAOYSA-N
XLogP-0.92
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.59
LogP ≤ 5-0.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chlorophenyl)acetic acid;sulfuric acid
CID 158269272
5-(2-chlorophenyl)-4-oxopentanoic acid
CID 66338254
3-[(2-chlorophenyl)methyl]but-3-enoic acid
CID 117268936
2-[2-[[(2-chlorophenyl)methyl-methylamino]methyl]phenyl]acetic acid
CID 115462653
CID 172781001
CID 172781001
CID 172781038
CID 172781038
2-(2-chlorophenyl)-N,N-diphenylacetamide
CID 54344934
S-phenyl 2-(2-chlorophenyl)ethanethioate
CID 135084649
strontium;2-[2-(2,6-dichloroanilino)phenyl]acetic acid;hydride
CID 173032882
(Z)-5-(2-chlorophenyl)pent-3-enoic acid
CID 117267940
16-(2-chlorophenyl)hexadecanoic acid
CID 174356057
1-(2-chlorophenyl)-3-(2,6-dichlorophenyl)propan-2-one
CID 63409565

Frequently Asked Questions

What is the IUPAC name of sodium;2-(2-chlorophenyl)acetic acid;hydride?
The IUPAC name of sodium;2-(2-chlorophenyl)acetic acid;hydride (CID 174699179) is sodium;2-(2-chlorophenyl)acetic acid;hydride.
What is the SMILES notation for sodium;2-(2-chlorophenyl)acetic acid;hydride?
The canonical SMILES for sodium;2-(2-chlorophenyl)acetic acid;hydride is O=C(O)Cc1ccccc1Cl.[H-].[Na+].
What is the InChIKey of sodium;2-(2-chlorophenyl)acetic acid;hydride?
The InChIKey is BNZAFNWCLGUUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClO2.Na.H/c9-7-4-2-1-3-6(7)5-8(10)11;;/h1-4H,5H2,(H,10,11);;/q;+1;-1.
What are the key properties of sodium;2-(2-chlorophenyl)acetic acid;hydride?
sodium;2-(2-chlorophenyl)acetic acid;hydride has a molecular weight of 194.59 g/mol, XLogP of -0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;2-(2-chlorophenyl)acetic acid;hydride is sourced from PubChem (CID 174699179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).