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763865-81-2 | Carbonisocyanatidicacid, 2-(dimethylamino)ethyl ester (9CI)
CAS No: 763865-81-2 Catalog No: AG005CC6 MDL No:
Product Description
Catalog Number:
AG005CC6
Chemical Name:
Carbonisocyanatidicacid, 2-(dimethylamino)ethyl ester (9CI)
CAS Number:
763865-81-2
Molecular Formula:
C6H10N2O3
Molecular Weight:
158.1552
IUPAC Name:
2-(dimethylamino)ethyl N-(oxomethylidene)carbamate
InChI:
InChI=1S/C6H10N2O3/c1-8(2)3-4-11-6(10)7-5-9/h3-4H2,1-2H3
InChI Key:
MPZUPOTUTNWHSH-UHFFFAOYSA-N
SMILES:
CN(CCOC(=O)N=C=O)C
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.157g/mol
Monoisotopic Mass:
158.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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