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Structure

4-(3-Bromothien-2-yl)benzoic acid

CAS
930111-09-4
Catalog Number
ACM930111094
Category
Other Products
Molecular Weight
283.14
Molecular Formula
C11H7BrO2S
MSDS COA Spec Sheet

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Specification

Synonyms
4-(3-Bromothien-2-yl)benzoic acid
IUPAC Name
4-(3-bromothiophen-2-yl)benzoic acid
Canonical SMILES
C1=CC(=CC=C1C2=C(C=CS2)Br)C(=O)O
InChI Key
WAOAWGITQLHUFM-UHFFFAOYSA-N
Exact Mass
281.93500
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 4-(3-bromothien-2-yl)benzoic acid?

The molecular formula is C11H7BrO2S.

What is the molecular weight of 4-(3-bromothien-2-yl)benzoic acid?

The molecular weight is 283.14 g/mol

When was 4-(3-bromothien-2-yl)benzoic acid created in PubChem?

It was created on 2008-02-29.

What is the InChIKey for 4-(3-bromothien-2-yl)benzoic acid?

The InChIKey is WAOAWGITQLHUFM-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 4-(3-bromothien-2-yl)benzoic acid have?

It has 1 hydrogen bond donor count.

What is the topological polar surface area of 4-(3-bromothien-2-yl)benzoic acid?

The topological polar surface area is 65.5 Ų.

Does 4-(3-bromothien-2-yl)benzoic acid have any defined atom stereocenter counts?

It has 0 defined atom stereocenter counts.

How many rotatable bond counts does 4-(3-bromothien-2-yl)benzoic acid have?

It has 2 rotatable bond counts.

Is 4-(3-bromothien-2-yl)benzoic acid a canonicalized compound?

Yes, it is a canonicalized compound.

What is the exact mass of 4-(3-bromothien-2-yl)benzoic acid?

The exact mass is 281.93501 g/mol.

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