N,N-Bis(2-chloroethyl)aniline - ≥95% , CAS No.553-27-5

CAS: 553-27-5 Cat. No.: N693466 Molecular Weight: 218.12
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
Aniline mustard | Lymphochin | Lymphocin | Lymphoquin
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
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Size
Status
Price
Qty
1g
N693466-1g
4

$9.90

$14.90
Save $5.00 (33.56%)
5g
N693466-5g
2

$25.90

$38.90
Save $13.00 (33.42%)
25g
N693466-25g
2

$90.90

$136.90
Save $46.00 (33.60%)
100g
N693466-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$290.90

$436.90
Save $146.00 (33.42%)
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Aniline mustard | Lymphochin | Lymphocin | Lymphoquin
Specifications & Purity
≥95%
Storage
Store at 2-8°C, Protected from light, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
ACTIVATOR
Purity
≥95%
Names and Identifiers
Canonical SmilesC1=CC=C(C=C1)N(CCCl)CCCl
IUPAC NameN,N-bis(2-chloroethyl)aniline
InChIKeyROSJKFFLIXTTAW-UHFFFAOYSA-N
INCHI1S/C10H13Cl2N/c11-6-8-13(9-7-12)10-4-2-1-3-5-10/h1-5H,6-9H2
Isomeric SMILES C1=CC=C(C=C1)N(CCCl)CCCl
Alternate CAS 553-27-5
NSC Number 18429
MeSH Entry Terms Aniline Mustard;Lymphochin;Lymphocin;Lymphoquin;Mustard, Aniline;N,N-bis(2-chloroethyl)aniline;N,N-bis-(2-chloroethyl)aniline;N,N-Di(2-Chloroethyl)aniline
Molecular Weight 218.12

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic nitrogen compounds
ClassOrganonitrogen compounds
SubclassNitrogen mustard compounds
Intermediate Tree Nodes Not available
Direct ParentNitrogen mustard compounds
Alternative Parents Dialkylarylamines  Aniline and substituted anilines  Organopnictogen compounds  Organochlorides  Hydrocarbon derivatives  Alkyl chlorides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Nitrogen mustard - Benzenoid - Monocyclic benzene moiety - Tertiary amine - Organopnictogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Amine - Alkyl halide - Alkyl chloride - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as nitrogen mustard compounds. These are compounds having two beta-haloalkyl groups bound to a nitrogen atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
PGR Tclin Progesterone receptor (8562 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AR Tclin Androgen Receptor (11781 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
LNCaP (8286 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
B16 (5829 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
L1210 (27553 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
P388 (20296 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
W256 (236 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeDateItem
I2518302Certificate of AnalysisJul 09, 2025 N693466
I2518303Certificate of AnalysisJul 09, 2025 N693466
I2518374Certificate of AnalysisJul 09, 2025 N693466
I2518375Certificate of AnalysisJul 09, 2025 N693466
Chemical and Physical Properties
SensitivityLight sensitive
Molecular Weight218.120 g/mol
XLogP32.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass217.043 Da
Monoisotopic Mass217.043 Da
Topological Polar Surface Area3.200 Ų
Heavy Atom Count13
Formal Charge0
Complexity118.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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