2-(Bromobenzyl) mercaptan

• Catalog Number: ACM143888851
• Product Name: 2-(Bromobenzyl) mercaptan
• CAS: 143888-85-1
• Category: Bromine Series
• Synonyms: 2-Bromobenzyl mercaptan, (2-Bromobenzyl) mercaptan, 143888-85-1, 2-Bromobenzylmercaptan, (2-bromophenyl)methanethiol, 2-(bromobenzyl) mercaptan, SBB066540, (2-bromophenyl)methane-1-thiol, ZINC04244657, PubChem6847, AC1MCNAL, ACMC-20ao1u, (2-bromobenzyl)mercaptan, 2-Bromobenzenemethanethiol, (2-Bromo-phenyl)-methanethiol, 593982_ALDRICH, CTK3J1404, MolPort-000-160-101, AKOS009076010, AG-D-86702
• IUPAC Name: (2-bromophenyl)methanethiol
• Molecular Weight: 203.10
• Molecular Formula: C₇H₇BrS
• Canonical SMILES: C1=CC=C(C(=C1)CS)Br
• InChI Key: UJNSDLRPHRMVGZ-UHFFFAOYSA-N
• Boiling Point: 256-257ºC
• Flash Point: >110ºC
• Density: 1.527
• Exact Mass: 201.94500
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 1
• H-Bond Donor: 1
• Packing Group: III
• Safety Description: S23-S24/25
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 2-(Bromobenzyl) mercaptan?

The molecular formula of 2-(Bromobenzyl) mercaptan is C7H7BrS.

What is the molecular weight of 2-(Bromobenzyl) mercaptan?

The molecular weight of 2-(Bromobenzyl) mercaptan is 203.10 g/mol.

What is the IUPAC name of 2-(Bromobenzyl) mercaptan?

The IUPAC name of 2-(Bromobenzyl) mercaptan is (2-bromophenyl)methanethiol.

What is the CAS number of 2-(Bromobenzyl) mercaptan?

The CAS number of 2-(Bromobenzyl) mercaptan is 143888-85-1.

What is the XLogP3-AA value of 2-(Bromobenzyl) mercaptan?

The XLogP3-AA value of 2-(Bromobenzyl) mercaptan is 2.7.

How many hydrogen bond donor counts does 2-(Bromobenzyl) mercaptan have?

2-(Bromobenzyl) mercaptan has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 2-(Bromobenzyl) mercaptan have?

2-(Bromobenzyl) mercaptan has 1 hydrogen bond acceptor count.

How many rotatable bond counts does 2-(Bromobenzyl) mercaptan have?

2-(Bromobenzyl) mercaptan has 1 rotatable bond count.

What is the topological polar surface area of 2-(Bromobenzyl) mercaptan?

The topological polar surface area of 2-(Bromobenzyl) mercaptan is 1Ų.

Is 2-(Bromobenzyl) mercaptan a canonicalized compound?

Yes, 2-(Bromobenzyl) mercaptan is a canonicalized compound.