CAS
942153-03-9 Purity
---
942153-03-9 Purity
---
Inquiry Basket
2-Carboxy-5-fluoro-1-[(1-naphthalenyl)methyl]-1H-indole-3-acetic acid
CAS
942191-15-3
Catalog Number
ACM942191153
Category
Other Products
Molecular Weight
377.365143 [g/mol]
Molecular Formula
C22H16FNO4
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
3-(Carboxymethyl)-5-fluoro-1-(naphthalen-1-ylmethyl)-1H-indole-2-carboxylic acid, 942191-15-3, SureCN3275766, CTK8B5449, HIN2083, ANW-48768, AKOS015919665, AK-54059, BR-54059, KB-233501, W9662, 2-Carboxy-5-fluoro-1-[(1-naphthalenyl)methyl]-1H-indole-3-acetic acid
IUPAC Name
3-(carboxymethyl)-5-fluoro-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid
Canonical SMILES
C1=CC=C2C(=C1)C=CC=C2CN3C4=C(C=C(C=C4)F)C(=C3C(=O)O)CC(=O)O
InChI Key
AASYYGYJPZBFKC-UHFFFAOYSA-N
Exact Mass
377.10600
H-Bond Acceptor
5
H-Bond Donor
2
What is the molecular formula of 2-Carboxy-5-fluoro-1-[(1-naphthalenyl)methyl]-1H-indole-3-acetic acid?
The molecular formula is C22H16FNO4.
When was this compound created in PubChem?
The compound was created on December 10, 2007.
What is the molecular weight of 2-Carboxy-5-fluoro-1-[(1-naphthalenyl)methyl]-1H-indole-3-acetic acid?
The molecular weight is 377.4 g/mol.
What is the IUPAC name of this compound?
The IUPAC name is 3-(carboxymethyl)-5-fluoro-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid.
What is the Canonical SMILES of this compound?
The Canonical SMILES is C1=CC=C2C(=C1)C=CC=C2CN3C4=C(C=C(C=C4)F)C(=C3C(=O)O)CC(=O)O.
What is the InChIKey of this compound?
The InChIKey is AASYYGYJPZBFKC-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in this compound?
There are 2 hydrogen bond donor counts.
What is the topological polar surface area of this compound?
The topological polar surface area is 79.5 ².
Is the compound canonicalized?
Yes, the compound is canonicalized.
How many rotatable bond counts are there in this compound?
There are 5 rotatable bond counts.
Recommended Products
![5-Amino-1H-pyrazolo[3,4-b]pyridine](https://resource.alfa-chemistry.com/structure/942185-01-5.gif)
