1-Bromo-2-pentyne

• CAS: 16400-32-1
• Catalog Number: ACM16400321
• Category: Alkynyl
• Molecular Weight: 147.01
• Molecular Formula: C5H7Br
• Synonyms: 5-bromopent-3-yne; 1-Bromo-2-pentyne; 2-Pentyne,1-bromo; pent-2-ynyl bromide; 1-bromo-pent-2-yne; 2-Pentynyl Bromide; EINECS 240-451-2; 3-ethylpropargyl bromide
• IUPAC Name: 1-bromopent-2-yne
• Canonical SMILES: CCC#CCBr
• InChI Key: VDHGRVFJBGRHMD-UHFFFAOYSA-N
• Boiling Point: 142.5ºC at 760mmHg
• Flash Point: 45.1ºC
• Density: 1.366g/cm³
• EC Number: 240-451-2
• Exact Mass: 145.97300
• Hazard Statements: H225-H302 + H312 + H332
• RIDADR: UN 1993C 3 / PGIII
• Safety Description: 26-36
• Symbol: GHS02

Custom Q&A

What is the molecular formula of 1-Bromo-2-pentyne?

The molecular formula of 1-Bromo-2-pentyne is C5H7Br.

What is the molecular weight of 1-Bromo-2-pentyne?

The molecular weight of 1-Bromo-2-pentyne is 147.01 g/mol.

What is the IUPAC name of 1-Bromo-2-pentyne?

The IUPAC name of 1-Bromo-2-pentyne is 1-bromopent-2-yne.

What is the Canonical SMILES of 1-Bromo-2-pentyne?

The Canonical SMILES of 1-Bromo-2-pentyne is CCC#CCBr.

What is the InChIKey of 1-Bromo-2-pentyne?

The InChIKey of 1-Bromo-2-pentyne is VDHGRVFJBGRHMD-UHFFFAOYSA-N.

What is the CAS number of 1-Bromo-2-pentyne?

The CAS number of 1-Bromo-2-pentyne is 16400-32-1.

How many hydrogen bond donor counts does 1-Bromo-2-pentyne have?

1-Bromo-2-pentyne has a hydrogen bond donor count of 0.

How many rotatable bond counts does 1-Bromo-2-pentyne have?

1-Bromo-2-pentyne has a rotatable bond count of 0.

What is the heavy atom count of 1-Bromo-2-pentyne?

The heavy atom count of 1-Bromo-2-pentyne is 6.

Is 1-Bromo-2-pentyne a canonicalized compound?

Yes, 1-Bromo-2-pentyne is a canonicalized compound according to PubChem.