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Structure

(5-Bromobenzo[b]thiophen-3-yl)methanamine

CAS
744985-64-6
Catalog Number
ACM744985646
Category
Bromine Series
Molecular Weight
242.14
Molecular Formula
C9H8BrNS

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Specification

Synonyms
(5-BROMO-3-BENZO[B]THIENYL)METHYLAMINE;(5-Bromo-3-benzo[b]thienyl)methylamine 97%;(5-bromobenzo[b]thiophen-3-yl)methanamine hydrochloride
IUPAC Name
(5-bromo-1-benzothiophen-3-yl)methanamine;hydrochloride
InChI Key
FNRMMKSEZJLOTG-UHFFFAOYSA-N
Boiling Point
359.9ºC at 760 mmHg
Melting Point
37ºC
Flash Point
171.4ºC
Density
1.622g/cm³
Exact Mass
240.95600
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of (5-Bromobenzo[b]thiophen-3-yl)methanamine?

The molecular formula is C9H8BrNS.

When was the PubChem CID 7537503 created and last modified?

It was created on 2006-07-29 and last modified on 2023-12-02.

What is the IUPAC name of the compound?

The IUPAC name is (5-bromo-1-benzothiophen-3-yl)methanamine.

What is the InChIKey of the compound?

The InChIKey is DVYWOASQESEKEC-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

It has 1 hydrogen bond donor count.

What is the topological polar surface area of the compound?

The topological polar surface area is 54.3Ų.

How many rotatable bond counts does the compound have?

It has 1 rotatable bond count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the exact mass of the compound?

The exact mass is 240.95608 g/mol.

What is the complexity of the compound?

The complexity is 165.

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