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CAS 155742-64-6 manufacturers and suppliers on PharmaCompass

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JAIGTTPBXVVFPN-UHFFFAOYSA-N
Also known as: 155742-64-6, Hydrazinecarboxylic acid, 2-(2-chloro-1-iminoethyl)-, methyl ester, Methyl 2-(2-chloro-1-iminoethyl)hydrazine-1-carboxylate, Mfcd09840880, N'-(2-chloroethanimidoyl)methoxycarbohydrazide, 2-(2-chloro-1-iminoethyl)hydrazinecarboxylic acid methyl ester
Molecular Formula
C4H8ClN3O2
Molecular Weight
165.58  g/mol
InChI Key
JAIGTTPBXVVFPN-UHFFFAOYSA-N

1 2D Structure

JAIGTTPBXVVFPN-UHFFFAOYSA-N

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl N-[(1-amino-2-chloroethylidene)amino]carbamate
2.1.2 InChI
InChI=1S/C4H8ClN3O2/c1-10-4(9)8-7-3(6)2-5/h2H2,1H3,(H2,6,7)(H,8,9)
2.1.3 InChI Key
JAIGTTPBXVVFPN-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC(=O)NN=C(CCl)N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 155742-64-6

2. Hydrazinecarboxylic Acid, 2-(2-chloro-1-iminoethyl)-, Methyl Ester

3. Methyl 2-(2-chloro-1-iminoethyl)hydrazine-1-carboxylate

4. Mfcd09840880

5. N'-(2-chloroethanimidoyl)methoxycarbohydrazide

6. 2-(2-chloro-1-iminoethyl)hydrazinecarboxylic Acid Methyl Ester

7. 1185503-26-7

8. Bcp21350

9. Hydrazinecarboxylicacid, 2-(2-chloro-1-iminoethyl)-, Methyl Ester

10. Zinc22062217

11. Sy103019

12. C3681

13. Ft-0671184

14. 3-(1-amino-2-chloroethylidene)carbazic Acid Methyl Ester

15. N'-(2-chloro-1-imino-ethyl)-hydrazinecarboxylic Acid Methyl Ester

2.3 Create Date
2009-05-28
3 Chemical and Physical Properties
Molecular Weight 165.58 g/mol
Molecular Formula C4H8ClN3O2
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass165.0305042 g/mol
Monoisotopic Mass165.0305042 g/mol
Topological Polar Surface Area76.7 Ų
Heavy Atom Count10
Formal Charge0
Complexity147
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently Bonded Unit Count1
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