Products for Research Use Only
RegisterLogin

Carboxyphosphamide Benzyl Ester-d4

CAT: 0804-HY-W738320-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-W738320-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Carboxyphosphamide Benzyl Ester-d4 is the deuterium labeled Benzyl 3- ((amino (bis (2-chloroethyl) amino) phosphoryl) oxy) propanoate.
CAS Number
1276302-73-8
UNSPSC
12352005
Target
Isotope-Labeled Compounds
Related Pathways
Others
Field of Research
Others
Smiles
[2H]C([2H])(CN(CC([2H])([2H])Cl)P(=O)(N)OCCC(=O)OCC1=CC=CC=C1)Cl
Molecular Formula
C14H17D4Cl2N2O4P
Molecular Weight
387.23
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

Carboxyphosphamide Benzyl Ester-d4
CAS Number1276302-73-8
PubChem CID71314552
IUPAC Namebenzyl 3-[amino-[bis(2-chloro-2,2-dideuterioethyl)amino]phosphoryl]oxypropanoate
Molecular FormulaC14H21Cl2N2O4P
Molecular Weight387.2
XLogP1.4
Topological Polar Surface Area81.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Heavy Atom Count23
Formal Charge0
Complexity389
SMILES
[2H]C([2H])(CN(CC([2H])([2H])Cl)P(=O)(N)OCCC(=O)OCC1=CC=CC=C1)Cl
InChI
InChI=1S/C14H21Cl2N2O4P/c15-7-9-18(10-8-16)23(17,20)22-11-6-14(19)21-12-13-4-2-1-3-5-13/h1-5H,6-12H2,(H2,17,20)/i7D2,8D2
InChIKey
URRQYEVJTAKGKS-OSEHSPPNSA-N
Chemical Structure
2D Structure
2D structure of Carboxyphosphamide Benzyl Ester-d4
CAS: 1276302-73-8
CID: 71314552
Formula: C14H21Cl2N2O4P
MW: 387.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight387.2
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Exact Mass386.0867065
Monoisotopic Mass386.0867065
Topological Polar Surface Area81.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity389
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-141722S-01Carboxyphosphamide-d4
HY-W587524-01Carboxyphosphamide
HY-B1556S-01Benzyl salicylate-d4
HY-W741005-01O-Benzyl Psilocin-d4
HY-W013482S-01Benzyl 4-hydroxybenzoate-d4
HY-I0909S-01O-Benzyl Posaconazole-d4
HY-W011338S-01Benzyl butyl phthalate-d4
HY-Z0061-01Valsartan benzyl ester
HY-W739906-01Adefovir Diethyl Ester-d4
HY-14397S1-01Indomethacin-d4 Methyl Ester

Alternative Products

CatalogName
MBS6106108-01Carboxyphosphamide Benzyl Ester-d4
TRC-C181355-25MGCarboxyphosphamide Benzyl Ester
TRC-C181352-10MGCarboxyphosphamide-d4
TRC-P287518-10MG(1S)-Perindopril-d4 Benzyl Ester
sc-213635(1R) Perindopril-d4 Benzyl Ester
sc-213642(1S) Perindopril-d4 Benzyl Ester
TRC-B289042-25MGBenzyl Salicylate-d4
TRC-B233700-50MGN-Benzyl Ciprofloxacin Benzyl Ester
165734Octyl Benzyl Phthalate-d4
112081Carboxyphosphamide

Popular Products