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13329-70-9 | Urea, N,N,N'-tris(hydroxymethyl)-
CAS No: 13329-70-9 Catalog No: AG0014K5 MDL No:MFCD24549803
Product Description
Catalog Number:
AG0014K5
Chemical Name:
Urea, N,N,N'-tris(hydroxymethyl)-
CAS Number:
13329-70-9
Molecular Formula:
C4H10N2O4
Molecular Weight:
150.1332
MDL Number:
MFCD24549803
IUPAC Name:
1,1,3-tris(hydroxymethyl)urea
InChI:
InChI=1S/C4H10N2O4/c7-1-5-4(10)6(2-8)3-9/h7-9H,1-3H2,(H,5,10)
InChI Key:
XJBNELXWSXDUFP-UHFFFAOYSA-N
SMILES:
OCNC(=O)N(CO)CO
EC Number:
236-377-5
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
150.134g/mol
Monoisotopic Mass:
150.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
93A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2
Literature
| Title | Journal |
|---|---|
| Formaldehyde in the indoor environment. | Chemical reviews 20100414 |
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