PENTAERYTHRITOL DIBROMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H10Br2O2
Molecular Weight	261.94
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OCC(CO)(CBr)CBr

InChI

InChIKey=CHUGKEQJSLOLHL-UHFFFAOYSA-N

InChI=1S/C5H10Br2O2/c6-1-5(2-7,3-8)4-9/h8-9H,1-4H2

HIDE SMILES / InChI

Molecular Formula	C5H10Br2O2
Molecular Weight	261.94
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Use of an avian hepatocyte assay and the avian Toxchip Polymerse chain reaction array for testing prioritization of 16 organic flame retardants.	2014-03	24273086
Induction of DNA damage in human urothelial cells by the brominated flame retardant 2,2-bis(bromomethyl)-1,3-propanediol: role of oxidative stress.	2011-12-18	22019925
In vitro glucuronidation of 2,2-bis(bromomethyl)-1,3-propanediol by microsomes and hepatocytes from rats and humans.	2010-06	20200232
Chemical degradation of 2,2-bis(bromomethyl)propan-1,3-diol (DBNPG) in alkaline conditions.	2010-04	20189218
Absorption, distribution, metabolism, and excretion of 2,2-bis(bromomethyl)-1,3-propanediol in male fischer-344 rats.	2009-02	19029203
Application of genomic biomarkers to predict increased lung tumor incidence in 2-year rodent cancer bioassays.	2007-05	17311802
Retardation of organo-bromides in a fractured chalk aquitard.	2006-08-10	16690162
The utility of the guppy (Poecilia reticulata) and medaka (Oryzias latipes) in evaluation of chemicals for carcinogenicity.	2006-07	16581948
NTP carcinogenesis studies of 2,2-bis(bromomethyl)-1,3-propanediol, nitromethane, and 1,2,3-trichloropropane (cas nos. 3296-90-0, 75-52-5, and 96-18-4) in guppies (Poecilia reticulata) and medaka (Oryzias latipes) (Waterborne Studies).	2005-10	16362062
Predominant K-ras codon 12 G --> A transition in chemically induced lung neoplasms in B6C3F1 mice.	2004-01-10	14713543
2,2-bis(Bromomethyl)-1,3-propanediol (technical grade).	2004	21089814
Use of the Japanese medaka (Oryzias latipes) and guppy (Poecilia reticulata) in carcinogenesis testing under national toxicology program protocols.	2003-02-25	12597435
2,2-bis(Bromomethyl)-1,3-propanediol (technical grade).	2002	15318377
Identification of mammary carcinogens in rodent bioassays.	2002	11921183
Sugar-pendant diamines.	2001-06-01	11374998
Carcinogenic activity of the flame retardant, 2,2-bis(bromomethyl)-1,3-propanediol in rodents, and comparison with the carcinogenicity of other NTP brominated chemicals.	1998-01-23	9437797
NTP Toxicology and Carcinogenesis Studies of 2,2-Bis(Bromomethyl)-1,3-Propanediol (FR-1138(R)) (CAS No. 3296-90-0) in F344 Rats and B6C3F1 Mice (Feed Studies).	1996-05	12594523
Reproductive toxicity of 2,2-bis(bromomethyl)-1,3-propanediol in a continuous breeding protocol in Swiss (CD-1) mice.	1989-08	2792593
Kidney and urinary bladder lesions in F344/N rats and B6C3F1 mice after 13 weeks of 2,2-bis(bromomethyl)-1,3-propanediol administration.	1989-04	2731663

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:33:55 GMT 2025` Edited by `admin` on `Mon Mar 31 18:33:55 GMT 2025`
Record UNII	4ZHG182S25
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FR 522

Preferred Name

English

PENTAERYTHRITOL DIBROMIDE

Systematic Name

English

PENTAERYTHRITOL DIBROMOHYDRIN

Common Name

English

2,2-BIS(BROMOMETHYL)-1,3-PROPANEDIOL

Systematic Name

English

DIBROMOPENTAERYTHRITOL

Systematic Name

English

PENTAERYTHRITOL DIBROMIDE [HSDB]

Common Name

English

1,3-DIBROMO-2,2-DIHYDROXYMETHYLPROPANE

Systematic Name

English

NSC-9001

Code

English

DIBROMONEOPENTYL GLYCOL

Systematic Name

English

2,2-DIBROMOMETHYL-1,3-PROPANEDIOL

Systematic Name

English

1,3-DIBROMO-2,2-BIS(HYDROXYMETHYL)PROPANE

Systematic Name

English

1,3-DIBROMO-2,2-DIMETHYLOLPROPANE

Systematic Name

English

1,3-PROPANEDIOL, 2,2-BIS(BROMOMETHYL)-

Systematic Name

English

Code System Code Type Description

NSC

9001