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4-Chlorobenzamidine

HCID 203437
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
19563-04-3
Standard SMILES
N=C(N)c1ccc(Cl)cc1
InChIKey
LFCUMSZYMJRUHD-UHFFFAOYSA-N
Molecular formula
C7H7ClN2
Average molar mass
154.6 g/mol
Monoisotopic mass
154.0297759

Names & identifiers

Preferred name
4-Chlorobenzamidine
IUPAC
4-chlorobenzenecarboximidamide
English name
4-Chloro-benzamidine
Molecular formula
C7H7ClN2
Molecular weight
154.6

Names & synonyms

4-chlorobenzamidine4-chloro-benzamidine19563-04-34-Chlorobenzenecarboximidamide4-chlorobenzimidamide4-chlorobenzene-1-carboximidamidep-ChlorobenzamidineBenzenecarboximidamide, 4-chloro-MFCD009819734-chloranylbenzenecarboximidamideCDS1_000524Benzamidine, 4-chloro-
Show more names
Enamine_000272Maybridge1_002812Maybridge1_008682DivK1c_001564SCHEMBL1219593SCHEMBL76710184-Chlorobenzenecarboximidamide #CHEMBL1619866

Database identifiers

CAS
19563-04-3
PubChem CID
203437
DTXSID
DTXSID80276822
ChEMBL
CHEMBL1619866
Nikkaji
J301.927F

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
49.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
128

Physicochemical properties

Melting point
145 · 145-148 °C (decomp)
Boiling point
241.1 · 241.1±42.0 °C(Predicted)
Density
1.29 · 1.29±0.1 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
11.39 · 11.39±0.50(Predicted)

Chemistry & industry

Suppliers31 total

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
上海西浦化工有限公司+86 (21) 6715-7650 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
上海卡洛化学有限公司21-33526724 18930996265 · [email protected]
赛纳斯特化学(欢迎点击联系)021-60343070
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
天津荣燊化工有限公司18317763565; 18317763565 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
上海卡恩医药科技有限公司021-34979681; 17701870669 · [email protected]
安阳鸿蒙新材料有限公司0372-19588588067 19588588067 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
上海相辉医药科技有限公司[email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
湖北康鑫源顺医药化工有限公司027-51831887 15337167856 · [email protected]
郑州艾克姆化工有限公司037163312495 13303845143 · [email protected]
上海智乾生物科技有限公司[email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
重庆卡兰医药有限公司[email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
南京恩赐医药科技有限公司025-52714267-66 13813902930 · [email protected]
河南凯美优科技有限公司0372-15803728682 15803728682 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]

Related reactions

9 records
New reaction record
HRID 211074 reaction equation
HRID 211074As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 895488 reaction equation
HRID 895488As reactantuspto-grants-2005_07
HRID 983850 reaction equation
HRID 983850As reactantuspto-grants-2005_03
HRID 1783335 reaction equation
HRID 1783335As reactantuspto-grants-2009_03
HRID 1793904 reaction equation
HRID 1793904As reactantuspto-grants-2006_04
HRID 1823844 reaction equation
HRID 1823844As reactantuspto-grants-2006_05
HRID 2114907 reaction equation
HRID 2114907As reactantuspto-grants-2008_10
HRID 2170801 reaction equation
HRID 2170801As reactantuspto-grants-2015_06
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Compound notes

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