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Neopentyl glycol

CAS 126-30-7C5H12O2MW 104.15

Neopentyl glycol (CAS 126-30-7) — formula C5H12O2, molecular weight 104.15.

Product Overview

CAS Number126-30-7
Molecular FormulaC5H12O2
Molecular Weight104.15
Melting Point260.6 °F (USCG, 1999)
Boiling Point406.4 °F at 760 mmHg (USCG, 1999)
LogP0

Technical Profile

What this product is

Neopentyl glycol is a chemical compound with CAS registry number 126-30-7 and molecular formula C5H12O2 (molecular weight 104.15).

Identification

CAS number: 126-30-7

Its molecular formula C5H12O2 comprises 5 C, 12 H, 2 O atoms.

Also known as: Neopentyl glycol · 新戊二醇

Frequently Asked Questions

What is the CAS number of Neopentyl glycol?

The CAS registry number of Neopentyl glycol is 126-30-7.

What is the molecular formula and molecular weight of Neopentyl glycol?

Molecular formula C5H12O2, molecular weight 104.15.

What other names is Neopentyl glycol known by?

It is also registered under: Neopentyl glycol, 新戊二醇.

PubChem Public Data

Independent reference data for Neopentyl glycol (CAS 126-30-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number126-30-7
PubChem CID31344
Molecular formulaC5H12O2
IUPAC name2,2-dimethylpropane-1,3-diol
UNII (FDA)QI80HXD6S5

Computed descriptors

Molecular Weight104.15
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass104.083729621
Monoisotopic Mass104.083729621
Topological Polar Surface Area40.5
Heavy Atom Count7

Physicochemical values on record

Boiling Point406.4 °F at 760 mmHg (USCG, 1999)
Boiling Point207 °C
Boiling Point210 °C
Boiling Point206 °C @760 [mm Hg]
Melting Point260.6 °F (USCG, 1999)
Melting Point129.3 °C
Melting Point127 °C
Flash Point225 °F (USCG, 1999)
Flash Point265 °F (129 °C) (open cup)
Flash Point107 °C

Documented uses on record

    Pulp and Paper Processing [Category: Industry]Textiles (Fiber & Fabric Manufacturing) [Category: Industry]

    Synonyms and trade names

    Neopentyl glycol; 126-30-7; 2,2-Dimethylpropane-1,3-diol; 2,2-DIMETHYL-1,3-PROPANEDIOL; Dimethylolpropane; Neopentanediol; Neopentylene glycol; 1,3-Propanediol, 2,2-dimethyl-; Neopentylglycol; Neol; Dimethyltrimethylene glycol; Hydroxypivalyl alcohol; 2,2-Dimethyltrimethylene glycol; Nexcoat 600; 2,2-Dimethyl-1,3 propanediol; DTXSID8027036

    Regulatory listings held on file

    Regulatory & Food ContactFDA Cumulative Estimated Daily Intake (CEDI): FCS
    FDA Inventory of Food Contact Substances Listed in 21 CFR: FCS
    GHS notification summary1.9% (19 / 1013)

    GHS hazard classification

    GHS notification summary1.9% (19 / 1013)
    Reported hazard statementsH315 (21.1%), H318 (74.9%), H319 (22%)

    This chemical does not meet GHS hazard criteria for 1.9% (19 of 1013) of reports.

    H315 (21.1%): Causes skin irritation [Warning Skin corrosion/irritation]

    What the public record says

    Neopentyl glycol · CAS 126-30-7 · C5H12O2. UNII QI80HXD6S5. Boiling Point: 406.4 °F at 760 mmHg (USCG, 1999); Boiling Point: 207 °C; Boiling Point: 210 °C.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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