Structure

Propanoic acid,3-bromo-2-methyl-,methyl ester,(2S)-

CAS
98190-85-3
Catalog Number
ACM98190853
Category
Other Products
Molecular Weight
181.03
Molecular Formula
C5H9BrO2

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Specification

Synonyms
98190-85-3, Methyl (S)-(-)-3-Bromoisobutyrate, (-)-Methyl (S)-3-bromo-2-methylpropionate, (S)-(-)-3-Bromoisobutyric Acid Methyl Ester, (-)-Methyl (S)-beta-bromoisobutyrate, AC1NUHSN, propanoic acid, 3-bromo-2-methyl-, methyl ester, 324922_ALDRICH, AC1Q41I4, 17621_FLUKA, CTK5H9756, ANW-40912, (-)-Methyl (S)-|A-bromoisobutyrate, AKOS015833847, AKOS015894023, (S)-3-bromoisobutyric acid methyl ester, methyl (2S)-3-bromo-2-methylpropanoate, KB-05354, B2140, FT-0642361
IUPAC Name
methyl (2S)-3-bromo-2-methylpropanoate
InChI Key
FKWNAVCXZSQYTA-SCSAIBSYSA-N
Boiling Point
173.7ºC at 760mmHg
Flash Point
73.9ºC
Density
1.413g/cm³
Exact Mass
179.97900
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
26-36
WGK Germany
3
What is the molecular formula of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The molecular formula is C5H9BrO2.

What is the chemical structure of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The chemical structure is CC(CBr)C(=O)OC.

What is the CAS number of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The CAS number is 98190-85-3.

What is the molecular weight of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The molecular weight is 181.03 g/mol.

What is the IUPAC name of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The IUPAC name is methyl (2S)-3-bromo-2-methylpropanoate.

What is the InChI of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The InChI is InChI=1S/C5H9BrO2/c1-4(3-6)5(7)8-2/h4H,3H2,1-2H3/t4-/m1/s1.

What is the InChIKey of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The InChIKey is FKWNAVCXZSQYTA-SCSAIBSYSA-N.

What is the XLogP3-AA value of Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S)?

The XLogP3-AA value is 1.4.

How many hydrogen bond donor counts does Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S) have?

It has 0 hydrogen bond donor count.

How many hydrogen bond acceptor counts does Propanoic acid, 3-bromo-2-methyl-, methyl ester, (2S) have?

It has 2 hydrogen bond acceptor counts.

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