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25070-71-7 | Carbamic acid, 2-propenyl-, 1-methylethyl ester (9CI)
CAS No: 25070-71-7 Catalog No: AG002QD8 MDL No:
Product Description
Catalog Number:
AG002QD8
Chemical Name:
Carbamic acid, 2-propenyl-, 1-methylethyl ester (9CI)
CAS Number:
25070-71-7
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
IUPAC Name:
propan-2-yl N-prop-2-enylcarbamate
InChI:
InChI=1S/C7H13NO2/c1-4-5-8-7(9)10-6(2)3/h4,6H,1,5H2,2-3H3,(H,8,9)
InChI Key:
NMSMDNMDVYZOJS-UHFFFAOYSA-N
SMILES:
C=CCNC(=O)OC(C)C
NSC Number:
46570
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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