Products for Research Use Only
RegisterLogin

meta-Chlorambucil

CAT: 0572-TRC-C325130-5MGSize: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-C325130-5MGSize:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
134862-11-6
Synonyms
3-[Bis(2-chloroethyl)amino]benzenebutanoic Acid; Chlorambucil Impurity
Hazard Statement
No Data Available; UN number: UN2811; Packing Group: III
Purity
>95% (HPLC)
Smiles
OC(=O)CCCc1cccc(c1)N(CCCl)CCCl
Molecular Formula
C14H19Cl2NO2
Molecular Weight
304.21
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Meta-chlorambucil
CAS Number134862-11-6
PubChem CID71587488
IUPAC Name4-[3-[bis(2-chloroethyl)amino]phenyl]butanoic acid
Molecular FormulaC14H19Cl2NO2
Molecular Weight304.2
XLogP1.7
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count9
Heavy Atom Count19
Formal Charge0
Complexity258
SMILES
C1=CC(=CC(=C1)N(CCCl)CCCl)CCCC(=O)O
InChI
InChI=1S/C14H19Cl2NO2/c15-7-9-17(10-8-16)13-5-1-3-12(11-13)4-2-6-14(18)19/h1,3,5,11H,2,4,6-10H2,(H,18,19)
InChIKey
FQLHARAWUJAHCM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Meta-chlorambucil
CAS: 134862-11-6
CID: 71587488
Formula: C14H19Cl2NO2
MW: 304.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight304.2
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count9
Exact Mass303.0792842
Monoisotopic Mass303.0792842
Topological Polar Surface Area40.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity258
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-C325050-2.5GChlorambucil
TRC-C325050-25GChlorambucil
TRC-C325050-10GChlorambucil
TRC-C325052-100MGChlorambucil-d8
TRC-C325125-100MGortho-Chlorambucil
TRC-C325053-25MGChlorambucil-Glutathione
TRC-C325140-50MGChlorambucil Dimer Impurity
TRC-C325140-25MGChlorambucil Dimer Impurity
TRC-C325140-5MGChlorambucil Dimer Impurity
TRC-C325145-25MGChlorambucil Trimer Impurity

Alternative Products

CatalogName
454417-01Meta-Chlorambucil
100150Chlorambucil
AR-C02389-01Chlorambucil-d8
TYD-03497-01Chlorambucil-CoA
HY-13593R-01Chlorambucil (Standard)
461635-01Ortho-Chlorambucil
AR-C02399-01Chlorambucil EP Impurity G (ortho Chlorambucil)
456922N- (2-Hydroxyethyl) Chlorambucil (Chlorambucil EP Impurity A)

Popular Products