Name: Name:4-[Bis-(2-chloroethyl)amino]benzaldehyde
Brand: Angene
SKU: AG003KLC
Rating: 90 (10 reviews)

4-[Bis-(2-chloroethyl)amino]benzaldehyde

CAS No.:

1208-03-3

Catalog Number:

AG003KLC

Molecular Formula:

C11H13Cl2NO

Molecular Weight:

246.1330

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG003KLC

Chemical Name:

4-[Bis-(2-chloroethyl)amino]benzaldehyde

CAS Number:

1208-03-3

Molecular Formula:

C11H13Cl2NO

Molecular Weight:

246.1330

MDL Number:

MFCD00014132

IUPAC Name:

4-[bis(2-chloroethyl)amino]benzaldehyde

InChI:

InChI=1S/C11H13Cl2NO/c12-5-7-14(8-6-13)11-3-1-10(9-15)2-4-11/h1-4,9H,5-8H2

InChI Key:

PXUFHXLGUJLBMI-UHFFFAOYSA-N

SMILES:

ClCCN(c1ccc(cc1)C=O)CCCl

NSC Number:

19996

Properties

Complexity:

175

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.037g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

246.131g/mol

Monoisotopic Mass:

245.037g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

20.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4

Literature

Title	Journal
2-[3-((Z)-2-{4-[Bis(2-chloro-eth-yl)amino]-phen-yl}ethen-yl)-5,5-dimethyl-cyclo-hex-2-en-1-yl-idene]propane-dinitrile.	Acta crystallographica. Section E, Structure reports online 20110101

Properties