3-Amino-1,2-propanediol

CAS Number: 616-30-8

Molecular Formula: C3H9NO2

Purity: 3-Amino-1,2-propanediol 98% purity

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About 3-Amino-1,2-propanediol

3-Amino-1,2-propanediol (CAS 616-30-8) is a fundamental building block in the API intermediates market, primarily utilized for the synthesis of non-ionic iodinated contrast media such as iohexol and ioversol, which are seeing increased demand due to rising global medical imaging procedures. As a premier bulk chemical s...

Synonyms

1-aminopropanediol
1-aminopropanediol, (+-)-isomer
3-amino-1,2-propanediol
3-Amino-1,2-propanediol
616-30-8

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3-Amino-1,2-propanediol Specifications

CAS Number

616-30-8

Molecular Formula

C3H9NO2

Molecular Weight

91.11 g/mol

IUPAC Name

3-aminopropane-1,2-diol

Canonical SMILES

C(C(CO)O)N

InChI Key

KQIGMPWTAHJUMN-UHFFFAOYSA-N

InChI

InChI=1S/C3H9NO2/c4-1-3(6)2-5/h3,5-6H,1-2,4H2

EINECS Number

210-475-8

MDL Number

MFCD00008140

HSN No

29221990

CAS Number

616-30-8

Molecular Formula

C3H9NO2

Molecular Weight

91.11 g/mol

IUPAC Name

3-aminopropane-1,2-diol

Canonical SMILES

C(C(CO)O)N

InChI Key

KQIGMPWTAHJUMN-UHFFFAOYSA-N

InChI

InChI=1S/C3H9NO2/c4-1-3(6)2-5/h3,5-6H,1-2,4H2

EINECS Number

210-475-8

MDL Number

MFCD00008140

HSN No

29221990

Molecular Weight

91.11 g/mol

Purity

3-Amino-1,2-propanediol 98% purity

Melting Point

55-57 °C

Boiling Point

264-265 °C (739 mmHg)

Freezing point

55°C

Flash Point

155 °C

Density

1.175 g/mL

Precise Quality

616-30-8

PSA

66.5 Å²

logP

-2

Average mass

91.11 g/mol

Monoisotopic mass

91.063328530 Da

Molar mass

91.11 g/mol

Vapour pressure

0.01 hPa at 20 °C

Precautionary Statement Codes

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501

Hazard Classes and Categories

Skin Corr. 1B (94%) Eye Dam. 1 (59.8%)

Pharmaceutical Intermediate

A primary chemical building block used in the large-scale synthesis of iohexol and iodiferol, which serve as non-ionic contrast agents for X-ray computed tomography (X-CT) and medical imaging

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Cosmetic and Personal Care Ingredient

A multifunctional humectant and skin-conditioning agent incorporated into skincare formulations to enhance moisture retention, improve skin texture, and act as a gentle solvent

Chemical Synthesis Intermediate

A versatile chiral glycerol derivative and amino alcohol used in the production of specialty materials, biodegradable polymers, and as a reactant for creating complex bioactive templates.