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Nitrogen mustard compounds

Nitrogen mustard compounds

Nitrogen mustards are cytotoxic organic compounds with the chloroethylamine functional group, which consists of the following structure: Cl(CH2)2NR2, where R can be any organic group. They are nitrogen analogs of mustard gas.
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1 – 15 of 85 results
1

Cyclophosphamide monohydrate, 97%

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: N,N-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine;hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name N,N-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine;hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
2

Bis(2-chloroethyl)amine hydrochloride, 98%

CAS: 821-48-7 Molecular Formula: C4H10Cl3N Molecular Weight (g/mol): 178.481 MDL Number: MFCD00012515 InChI Key: YMDZDFSUDFLGMX-UHFFFAOYSA-N Synonym: bis 2-chloroethyl amine hydrochloride,2,2'-dichlorodiethylamine hydrochloride,2-chloro-n-2-chloroethyl ethanamine hydrochloride,nor-lost hydrochlorid,nor-hn2,ethanamine, 2-chloro-n-2-chloroethyl-, hydrochloride,n,n-bis 2-chloroethyl amine hydrochloride,di-2-chloroethyl amine hydrochloride,2,2-dichlorodiethylamine hydrochloride,bis-2-chloroethyl amine hydrochloride PubChem CID: 522769 IUPAC Name: 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride SMILES: C(CCl)NCCCl.Cl

PubChem CID 522769
CAS 821-48-7
Molecular Weight (g/mol) 178.481
MDL Number MFCD00012515
SMILES C(CCl)NCCCl.Cl
Synonym bis 2-chloroethyl amine hydrochloride,2,2'-dichlorodiethylamine hydrochloride,2-chloro-n-2-chloroethyl ethanamine hydrochloride,nor-lost hydrochlorid,nor-hn2,ethanamine, 2-chloro-n-2-chloroethyl-, hydrochloride,n,n-bis 2-chloroethyl amine hydrochloride,di-2-chloroethyl amine hydrochloride,2,2-dichlorodiethylamine hydrochloride,bis-2-chloroethyl amine hydrochloride
IUPAC Name 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride
InChI Key YMDZDFSUDFLGMX-UHFFFAOYSA-N
Molecular Formula C4H10Cl3N
3

Cyclophosphamide, 99.5%, MP Biomedicals™

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
4

Cyclophosphamide Monohydrate 98.0+%, TCI America™
SDP

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
5

Bis(2-chloroethyl)amine hydrochloride, 98%

EDGE
6

Perfluorotributylamine, Mass Spec Std, Thermo Scientific Chemicals

CAS: 311-89-7 Molecular Formula: C12F27N Molecular Weight (g/mol): 671.096 MDL Number: MFCD00000436 InChI Key: RVZRBWKZFJCCIB-UHFFFAOYSA-N Synonym: perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine PubChem CID: 9397 ChEBI: CHEBI:38854 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine SMILES: C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

PubChem CID 9397
CAS 311-89-7
Molecular Weight (g/mol) 671.096
ChEBI CHEBI:38854
MDL Number MFCD00000436
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Synonym perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine
InChI Key RVZRBWKZFJCCIB-UHFFFAOYSA-N
Molecular Formula C12F27N
7

Cyclophosphamide Monohydrate, MP Biomedicals

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
8

Perfluorotri-n-butylamine, tech. 90%, Thermo Scientific Chemicals

CAS: 311-89-7 Molecular Formula: C12F27N Molecular Weight (g/mol): 671.096 MDL Number: MFCD00000436 InChI Key: RVZRBWKZFJCCIB-UHFFFAOYSA-N Synonym: perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine PubChem CID: 9397 ChEBI: CHEBI:38854 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine SMILES: C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

PubChem CID 9397
CAS 311-89-7
Molecular Weight (g/mol) 671.096
ChEBI CHEBI:38854
MDL Number MFCD00000436
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Synonym perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine
InChI Key RVZRBWKZFJCCIB-UHFFFAOYSA-N
Molecular Formula C12F27N
9

Perfluorotributylamine, MP Biomedicals

CAS: 311-89-7 Molecular Formula: C12F27N Molecular Weight (g/mol): 671.096 InChI Key: RVZRBWKZFJCCIB-UHFFFAOYSA-N Synonym: perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine PubChem CID: 9397 ChEBI: CHEBI:38854 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine SMILES: C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

PubChem CID 9397
CAS 311-89-7
Molecular Weight (g/mol) 671.096
ChEBI CHEBI:38854
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Synonym perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine
InChI Key RVZRBWKZFJCCIB-UHFFFAOYSA-N
Molecular Formula C12F27N
10

N-methyl-bis(trifluoroacetamide), 98%

CAS: 685-27-8 Molecular Formula: C5H3F6NO2 Molecular Weight (g/mol): 223.07 InChI Key: AWGBWLXGUPTXHF-UHFFFAOYSA-N Synonym: mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide PubChem CID: 69635 IUPAC Name: 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide SMILES: CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F

PubChem CID 69635
CAS 685-27-8
Molecular Weight (g/mol) 223.07
SMILES CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F
Synonym mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide
IUPAC Name 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
InChI Key AWGBWLXGUPTXHF-UHFFFAOYSA-N
Molecular Formula C5H3F6NO2
11

N-Methyl-bis(trifluoroacetamide), ≥97.0% (GC), MilliporeSigma™ Supelco™

MDL Number: MFCD00000412 Synonym: MBTFA (N-methyl-bis(trifluoroacetamide)or BTFA (bis(TFA)); MBTFA

MDL Number MFCD00000412
Synonym MBTFA (N-methyl-bis(trifluoroacetamide)or BTFA (bis(TFA)); MBTFA
12

Bis(2,2,2-trifluoroethyl)amine, 95%

CAS: 407-01-2 Molecular Formula: C4H5F6N Molecular Weight (g/mol): 181.081 MDL Number: MFCD00042094 InChI Key: GTJGHXLFPMOKCE-UHFFFAOYSA-N PubChem CID: 78999 IUPAC Name: 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine SMILES: C(C(F)(F)F)NCC(F)(F)F

PubChem CID 78999
CAS 407-01-2
Molecular Weight (g/mol) 181.081
MDL Number MFCD00042094
SMILES C(C(F)(F)F)NCC(F)(F)F
IUPAC Name 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine
InChI Key GTJGHXLFPMOKCE-UHFFFAOYSA-N
Molecular Formula C4H5F6N
13

N,N-Bis(2-chloroethyl)-p-toluenesulfonamide, tech. 90%

CAS: 42137-88-2 Molecular Formula: C11H15Cl2NO2S Molecular Weight (g/mol): 296.206 MDL Number: MFCD00018944 InChI Key: PTVBBIMKLOMGSY-UHFFFAOYSA-N Synonym: n,n-bis 2-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-p-toluenesulphonamide,n,n-bis .beta.-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-toluenesulfonamide,n,n-bis 2'-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulphonamide,benzenesulfonamide, n,n-bis 2-chloroethyl-4-methyl,n,n-bis-2-chloro-ethyl-4-methyl-benzenesulfonamide PubChem CID: 96039 IUPAC Name: N,N-bis(2-chloroethyl)-4-methylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(CCCl)CCCl

PubChem CID 96039
CAS 42137-88-2
Molecular Weight (g/mol) 296.206
MDL Number MFCD00018944
SMILES CC1=CC=C(C=C1)S(=O)(=O)N(CCCl)CCCl
Synonym n,n-bis 2-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-p-toluenesulphonamide,n,n-bis .beta.-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-toluenesulfonamide,n,n-bis 2'-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulphonamide,benzenesulfonamide, n,n-bis 2-chloroethyl-4-methyl,n,n-bis-2-chloro-ethyl-4-methyl-benzenesulfonamide
IUPAC Name N,N-bis(2-chloroethyl)-4-methylbenzenesulfonamide
InChI Key PTVBBIMKLOMGSY-UHFFFAOYSA-N
Molecular Formula C11H15Cl2NO2S
14

N-Methylbis(trifluoroacetamide) 97.0+%, TCI America™
SDP

CAS: 685-27-8 Molecular Formula: C5H3F6NO2 Molecular Weight (g/mol): 223.074 MDL Number: MFCD00000412 InChI Key: AWGBWLXGUPTXHF-UHFFFAOYSA-N Synonym: mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide PubChem CID: 69635 IUPAC Name: 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide SMILES: CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F

PubChem CID 69635
CAS 685-27-8
Molecular Weight (g/mol) 223.074
MDL Number MFCD00000412
SMILES CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F
Synonym mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide
IUPAC Name 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
InChI Key AWGBWLXGUPTXHF-UHFFFAOYSA-N
Molecular Formula C5H3F6NO2
15

Chlorambucil 98.0+%, TCI America™
SDP

CAS: 305-03-3 Molecular Formula: C14H19Cl2NO2 Molecular Weight (g/mol): 304.21 MDL Number: MFCD00021783 InChI Key: JCKYGMPEJWAADB-UHFFFAOYSA-N Synonym: chlorambucil,ambochlorin,chloroambucil,leukeran,chloraminophen,chlorbutin,chloraminophene,chlorobutine,amboclorin,chlorbutine PubChem CID: 2708 ChEBI: CHEBI:28830 IUPAC Name: 4-{4-[bis(2-chloroethyl)amino]phenyl}butanoic acid SMILES: OC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl

PubChem CID 2708
CAS 305-03-3
Molecular Weight (g/mol) 304.21
ChEBI CHEBI:28830
MDL Number MFCD00021783
SMILES OC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl
Synonym chlorambucil,ambochlorin,chloroambucil,leukeran,chloraminophen,chlorbutin,chloraminophene,chlorobutine,amboclorin,chlorbutine
IUPAC Name 4-{4-[bis(2-chloroethyl)amino]phenyl}butanoic acid
InChI Key JCKYGMPEJWAADB-UHFFFAOYSA-N
Molecular Formula C14H19Cl2NO2