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Home > Aldehydes > 1135221-62-3
1135221-62-3 | 4-HYDROXY-3-MORPHOLIN-4-YLMETHYL-BENZALDEHYDE HYDROCHLORIDE
CAS No: 1135221-62-3 Catalog No: AG01EMBB MDL No:MFCD11506422
Product Description
Catalog Number:
AG01EMBB
Chemical Name:
4-HYDROXY-3-MORPHOLIN-4-YLMETHYL-BENZALDEHYDE HYDROCHLORIDE
CAS Number:
1135221-62-3
Molecular Formula:
C12H16ClNO3
Molecular Weight:
257.7133
MDL Number:
MFCD11506422
IUPAC Name:
4-hydroxy-3-(morpholin-4-ylmethyl)benzaldehyde;hydrochloride
InChI:
InChI=1S/C12H15NO3.ClH/c14-9-10-1-2-12(15)11(7-10)8-13-3-5-16-6-4-13;/h1-2,7,9,15H,3-6,8H2;1H
InChI Key:
JCMQAKJJIXRNTC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)CN1CCOCC1)O.Cl
NSC Number:
512711
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.082g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.714g/mol
Monoisotopic Mass:
257.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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