CAS 14941-52-7|(2H4)benzene|Benzene-1,2,3,5-d4|(2H4)benzene|苯-1,2,3,5-d4

InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H

UHOVQNZJYSORNB-UHFFFAOYSA-N

H Acceptors

H Donor

LogD (pH = 5.5)

1.9732459

LogD (pH = 7.4)

1.9732459

Log P

1.9732459

Molar Refractivity

26.058

Polarizability

10.423977

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Benzene-1,2,3,5-d4苯-1,2,3,5-d4

IUPAC Traditional name

UN 1114 3/PG 2

53-45

Danger

C6D4H2

99 atom % D

mol wt 82.10 by atom % calculation

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586439

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

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Data Source

Commercial Catalog

Academic Data

Names and Identifiers

IUPAC name

(²H₄)benzene

Synonyms

Benzene-1,2,3,5-d4苯-1,2,3,5-d4

IUPAC Traditional name

(²H₄)benzene

Registration numbers

PubChem SID

MDL Number

CAS Number

PubChem CID

Molecule Details

586439

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

References

PubChem Literature

No Data Available

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Bioactivity

PubChem BioAssay

German water hazard class

UN Number

1114

GHS Pictograms

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

Respiratory sensitization, category 1

Germ cell mutagenicity, categories 1A,1B,2

Carcinogenicity, categories 1A,1B,2

Reproductive toxicity, categories 1A,1B,2

Specific Target Organ Toxicity – Single exposure, categories 1,2

Specific Target Organ Toxicity – Repeated exposure, categories 1,2

Aspiration Hazard, category 1

European Hazard Symbols

Flammable (F)

Toxic (T)

MSDS Link

Download link

Packing Group

GHS Hazard statements

H225-H304-H315-H319-H340-H350-H372

GHS Precautionary statements

P201-P210-P301+P310-P305+P351+P338-P308+P313-P331

Risk Statements

45-46-11-36/38-48/23/24/25-65

Molecule

ID:134769