CAS 77435-60-0|Ethylenediamine-13C2 dihydrochloride|(1,2-13C2)ethane-1,2-diamine dihydrochloride|(1,2-13C2)ethane-1,2-diamine dihydr...

Molecular Formula

C₂H₁₀Cl₂N₂

Molecular Mass

135.00550968

Exact Mass

134.02881337

InChI

InChI=1S/C2H8N2.2ClH/c3-1-2-4;;/h1-4H2;2*1H/i1+1,2+1;;

InChIKey

OHHBFEVZJLBKEH-BQTCFENJSA-N

Canonic Smiles

N[13CH2][13CH2]N.Cl.Cl

Isomeric Smiles

[13CH2]([13CH2]N)N.Cl.Cl

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-5.91292

LogD (pH = 7.4)

-3.7797713

Log P

-1.4224427

Molar Refractivity

17.8686

Polarizability

7.4730473

Polar Surface Area

52.04

Rotatable Bonds

Lipinski's Rule of Five

true

Commercial Catalog

Academic Data

Synonyms

Ethylenediamine-13C2 dihydrochloride乙二胺-13C2 二盐酸盐

IUPAC name

(1,2-¹³C₂)ethane-1,2-diamine dihydrochloride

IUPAC Traditional name

(1,2-¹³C₂)ethane-1,2-diamine dihydrochloride

CAS Number

PubChem SID

MDL Number

PubChem CID

Product Information

Linear Formula

H2N13CH213CH2NH2 . 2HCl

Isotopic Purity

99 atom % 13C

Mol. Weight

mol wt 134.99 by atom % calculation

Risk Statements

22-36/37/38-42/43

GHS Pictograms

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

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

MSDS Link

Download link

GHS Precautionary statements

P261-P280-P305+P351+P338-P342+P311

European Hazard Symbols

Harmful (Xn)

GHS Signal Word

Danger

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

GHS Hazard statements

H302-H315-H317-H319-H334-H335

Safety Statements

24/25

German water hazard class

Physical Property

Melting Point

300 °C(lit.)

Mass Shift

M+2

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Sigma Aldrich

586943

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.

No Data Available

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Commercial Catalog

Academic Data

Synonyms

Ethylenediamine-13C2 dihydrochloride乙二胺-13C2 二盐酸盐

IUPAC name

(1,2-¹³C₂)ethane-1,2-diamine dihydrochloride

IUPAC Traditional name

(1,2-¹³C₂)ethane-1,2-diamine dihydrochloride

CAS Number

PubChem SID

MDL Number

PubChem CID

586943

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.

No Data Available

Click here to submit data

Product Information

Linear Formula

H2N13CH213CH2NH2 . 2HCl

Isotopic Purity

99 atom % 13C

Mol. Weight

mol wt 134.99 by atom % calculation

Safety Information

Physical Property

Melting Point

300 °C(lit.)

Mass Shift

M+2

Molecule

ID:134727